data_2lc9_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 2lc9 _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 . . . . . . . . . . . . . 41.8 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 . . . . . . . . . . . . . 26.2 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 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.469 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 . . . . . . . . . . . . . 55.1 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 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 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 . 001 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.1 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 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.7 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 . 001 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 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 93.9 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 . . . . . . . . . . . . . 88.4 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 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 44.4 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 . . . . . . . . . . . . . 78.7 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 . . . . . . . . . . . . . 90.4 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 . 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 . . . . . . . . . . . . . 87.3 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 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 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 88.5 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 . 001 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 . 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 . . . . . . . . . . . . . 60.5 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 . . . . . . . . . . . . . 86.4 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 . . . . . . . . . . . . . 63.4 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 . . . . . . . . . . . . . 89.5 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 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 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 . 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 . . . . . . . . . . . . . 41.0 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.4 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 . . . . . 0.504 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 . 001 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 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 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 . . . . . 0.424 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 . 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 . . . . . 0.424 ' 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 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.8 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 . . . . . . . . . . . . . 43.1 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 . 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 . . . . . . . . . . . . . 62.5 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 . 001 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 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 89.5 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 . . . . . . . . . . . . . 97.0 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 . . . . . . . . . . . . . 64.9 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 . . . . . 0.4 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 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.9 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 . 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 . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 001 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 . 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 . . . . . . . . . . . . . 79.6 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 . . . . . . . . . . . . . 93.0 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 . . . . . . . . . . . . . 32.3 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 . 001 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 . 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 . . . . . . . . . . . . . 99.7 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 . . . . . . . . . . . . . 97.6 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 . . . . . . . . . . . . . 58.5 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 . . . . . 0.464 HG22 ' HB3' ' A' ' 118' ' ' LEU . 70.7 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 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 59.0 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 . . . . . . . . . . . . . 96.2 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 . 001 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 . 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 . . . . . . . . . . . . . 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 . 001 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 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.5 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 . 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 . . . . . 0.469 HG21 HG12 ' A' ' 3' ' ' ILE . 96.7 mt -55.66 -39.67 56.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.764 0.316 . . . . 0.0 111.186 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -66.75 -47.0 73.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.141 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.0 mmm -61.72 -25.92 67.73 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.217 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 103' ' ' VAL . 44.4 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.561 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.5 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.788 0.328 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 71.4 Cg_exo -56.05 -41.94 71.79 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.678 1.585 . . . . 0.0 111.25 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.46 ' HB3' ' HB3' ' A' ' 129' ' ' ALA . 36.1 mmt -65.77 -42.96 90.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.195 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.32 -51.14 70.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.15 176.83 . . . . . . . . 1 1 . 1 . 001 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 119.671 -0.812 . . . . 0.0 111.873 -174.575 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 001 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 . 001 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 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.46 ' HB3' ' 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 . 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 . . . . . . . . . . . . . 53.3 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 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -65.65 -32.8 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.223 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.28 -34.3 74.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.193 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.16 -15.97 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.238 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.7 mttt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.18 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo . . . . . 0 N--CA 1.458 -0.579 0 N-CA-C 111.212 -0.341 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -69.54 -50.61 43.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.165 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.11 -36.59 84.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.791 0.329 . . . . 0.0 111.203 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.64 -41.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.216 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.157 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 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 . 001 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.4 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 . . . . . . . . . . . . . 96.4 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 . 001 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 17.0 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 . 001 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.4 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 . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 70.9 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 . 001 nuclear orig core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.7 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 . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 41.7 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 . . . . . . . . . . . . . 26.2 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 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.497 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 . 002 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 . 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 . . . . . . . . . . . . . 11.4 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 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 101' ' ' ASN . 84.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.5 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 . . . . . . . . . . . . . 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 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.0 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 . . . . . . . . . . . . . 64.0 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . 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 . 002 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 . 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 . 49.5 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 . 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 . 54.6 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 . 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 . . . . . . . . . . . . . 48.1 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 25.3 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 93.2 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 99.4 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 . 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 . . . . . . . . . . . . . 58.8 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 . 002 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 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.442 HG22 ' HB3' ' A' ' 118' ' ' LEU . 73.1 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 . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 002 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 002 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 . 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 . . . . . 0.497 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -55.51 -40.45 58.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.769 0.319 . . . . 0.0 111.192 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.412 ' HA ' HD22 ' A' ' 7' ' ' LEU . 52.2 t-20 -65.66 -41.11 92.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.239 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 97.0 mmm -63.79 -33.57 75.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 63.7 t . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.235 178.14 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.601 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 51.1 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.768 0.318 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 49.3 Cg_exo -62.48 -44.32 18.59 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.644 1.563 . . . . 0.0 111.233 -178.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 34.9 mmt -65.96 -40.93 91.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.206 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -59.15 -49.74 76.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.232 176.309 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.717 . . . . . . . . 1 1 . 1 . 002 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 . 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 . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -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 . . . . . . . . . . . . . 53.1 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 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.92 -41.36 64.35 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 . . . . . . . . . . . . . 83.1 mt -75.38 -37.29 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.15 65.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.199 -176.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.0 mttt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 179.791 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 111.199 -0.347 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -76.1 -48.11 21.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.193 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -74.4 -35.76 63.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.203 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.3 88.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.204 -179.772 . . . . . . . . 1 1 . 1 . 002 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 116.187 -0.461 . . . . 0.0 112.157 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 65.7 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 . . . . . . . . . . . . . 84.0 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 . . . . . . . . . . . . . 83.2 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 . 002 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 . 002 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.2 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 . . . . . . . . . . . . . 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 . 002 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 43.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 96.6 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 . 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.2 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 . 003 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 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 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 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.2 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 . . . . . . . . . . . . . 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 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 79.1 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 . . . . . . . . . . . . . 90.6 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 . 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 . . . . . . . . . . . . . 87.2 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.4 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 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 90.3 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 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 . 003 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 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.0 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 . . . . . . . . . . . . . 99.3 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 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.9 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 . 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 . . . . . . . . . . . . . 29.1 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 . 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 . . . . . . . . . . . . . 48.1 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 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.9 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 . . . . . 0.504 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 . 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 . . . . . . . . . . . . . 27.4 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 . . . . . 0.42 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 . 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 . . . . . 0.42 ' 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 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.1 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 . . . . . . . . . . . . . 40.7 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 . . . . . . . . . . . . . 2.9 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 . . . . . . . . . . . . . 90.1 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 . 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 . . . . . . . . . . . . . 68.8 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 64.4 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 . . . . . 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 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.4 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 . . . . . . . . . . . . . 45.6 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 . 003 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 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.5 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . 0.47 HG22 ' HB3' ' A' ' 118' ' ' LEU . 77.0 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 . . . . . . . . . . . . . 72.2 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 . 003 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 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 93.0 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 . 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 . . . . . . . . . . . . . 96.3 mt -59.52 -30.04 43.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.815 0.34 . . . . 0.0 111.199 177.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -77.0 -39.27 51.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 177.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 93.1 mmm -60.99 -44.7 97.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.218 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.4 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.233 -178.616 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.591 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 49.2 mt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.781 0.324 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.591 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 75.4 Cg_exo -56.21 -43.4 56.49 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 121.708 1.605 . . . . 0.0 111.171 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.7 mmt -66.61 -38.32 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.184 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.04 -47.55 74.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.216 178.422 . . . . . . . . 1 1 . 1 . 003 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 119.671 -0.812 . . . . 0.0 111.873 179.722 . . . . . . . . 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 . . . . . . . . . . . . . 81.7 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 . 003 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 003 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 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -64.29 -34.44 78.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.206 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -73.81 -34.74 64.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.238 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -16.48 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.164 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.6 mttt . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.238 178.828 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo . . . . . 0 N--CA 1.458 -0.592 0 N-CA-C 111.167 -0.359 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -70.78 -56.67 5.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.2 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -59.89 -45.15 93.44 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 125.05 1.34 . . . . 0.0 111.165 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -60.91 -43.39 98.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.219 177.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.157 176.966 . . . . . . . . 1 1 . 1 . 003 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 . 003 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.7 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 . . . . . . . . . . . . . 90.2 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 . 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 . . . . . . . . . . . . . 19.8 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 . . . . . . . . . . . . . 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 . 003 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.7 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 . 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 . . . . . . . . . . . . . 68.9 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 . . . . . . . . . . . . . 91.0 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 . . . . . . . . . . . . . 95.4 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 . . . . . . . . . . . . . 96.5 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 . . . . . 0.419 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 30.8 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 . . . . . . . . . . . . . 61.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.433 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 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.1 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 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 17.9 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 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 84.6 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 . 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 . . . . . . . . . . . . . 87.3 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 . 004 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 . 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 . . . . . . . . . . . . . 42.0 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 . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 69.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 90.0 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 . . . . . 0.503 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 . 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 . . . . . . . . . . . . . 65.5 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 . . . . . . . . . . . . . 85.6 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 . 004 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 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 87.8 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 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 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 . . . . . . . . . . . . . 44.6 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . 0.503 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 . 004 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 . 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 . . . . . 0.421 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 . 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 . . . . . 0.421 ' 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 . 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 . . . . . . . . . . . . . 31.2 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 . 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 . . . . . . . . . . . . . 50.8 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 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.7 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 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.3 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.6 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 . 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 . . . . . . . . . . . . . 25.4 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 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.4 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 . . . . . . . . . . . . . 69.0 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 95.2 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 . 004 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 . 004 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 . 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 . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 58.7 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 . . . . . 0.478 HG22 ' HB3' ' A' ' 118' ' ' LEU . 77.6 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 . . . . . . . . . . . . . 74.0 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 . . . . . . . . . . . . . 57.4 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 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 7.4 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.5 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 . . . . . 0.433 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -37.03 59.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.407 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 55.1 t-20 -76.6 -32.37 58.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.168 179.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 tpp -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.164 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.214 179.519 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.574 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 47.8 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.775 0.321 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 53.2 Cg_exo -57.37 -42.54 60.83 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.714 1.609 . . . . 0.0 111.207 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -64.91 -43.2 93.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.192 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.68 -47.93 84.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.206 177.061 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -176.649 . . . . . . . . 1 1 . 1 . 004 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 . 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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -61.61 -35.96 79.36 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 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.36 -33.71 67.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 -176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.64 62.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.19 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 178.456 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo . . . . . 0 N--CA 1.457 -0.629 0 N-CA-C 111.222 -0.338 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.75 -49.48 38.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.238 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -69.66 -37.73 76.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.173 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.75 -37.46 82.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.197 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.9 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 . . . . 0.0 112.157 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 96.3 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 . 004 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.3 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 . 004 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 . 004 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.3 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 . . . . . . . . . . . . . 30.8 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 96.7 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 . 004 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' 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 . . . . . . . . 2 2 . 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 . . . . . . . . . . . . . 41.7 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 . . . . . 0.423 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 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.0 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 9.9 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 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.2 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 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.9 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 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.6 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 . 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 . . . . . . . . . . . . . 78.9 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 . . . . . . . . . . . . . 87.3 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 . 005 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 80.9 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 . . . . . . . . . . . . . 58.6 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 . 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 86.5 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.5 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 87.7 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 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.5 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 . . . . . . . . . . . . . 41.4 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 . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 84.5 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 . 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 . . . . . 0.422 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 . 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 . . . . . 0.422 ' 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 . 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 . . . . . . . . . . . . . 43.7 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 . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 62.5 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 . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.8 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 . 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 . . . . . . . . . . . . . 99.8 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.0 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 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 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.5 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 . 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 . . . . . . . . . . . . . 58.8 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 . 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 . . . . . . . . . . . . . 7.3 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 . 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 . . . . . . . . . . . . . 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 . 005 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 orig core ' A' A ' 99' ' ' ALA . . . . . 0.402 ' O ' HG23 ' A' ' 103' ' ' VAL . . . -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 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.423 HG21 HG12 ' A' ' 3' ' ' ILE . 96.2 mt -58.08 -29.24 36.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.788 0.327 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -78.99 -35.59 42.66 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 125.358 1.463 . . . . 0.0 111.212 178.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.2 mmm -70.98 -15.14 62.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.216 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 99' ' ' ALA . 25.6 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 -178.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.551 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 71.4 mt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.798 0.333 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 98.2 Cg_exo -50.33 -46.06 30.89 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.739 1.626 . . . . 0.0 111.185 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.2 mmt -66.05 -41.88 90.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.78 -47.89 83.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.23 -179.287 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.758 . . . . . . . . 1 1 . 1 . 005 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 . 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 . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 94.7 m-20 -65.97 -34.95 79.29 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 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.43 -31.39 67.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 177.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.0 -14.69 63.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.205 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.264 178.935 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo . . . . . 0 N--CA 1.458 -0.611 0 N-CA-C 111.245 -0.329 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -66.17 -53.48 36.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.158 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.31 -64.49 0.85 Allowed 'General case' 0 C--N 1.319 -0.757 0 O-C-N 122.01 -0.431 . . . . 0.0 111.19 175.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -44.37 -44.0 7.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.243 178.778 . . . . . . . . 1 1 . 1 . 005 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 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 005 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 . 005 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 . 005 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 19.1 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 . 005 nuclear orig core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.2 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 . . . . . . . . . . . . . 82.1 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 . . . . . . . . . . . . . 53.8 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 . . . . . . . . . . . . . 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 . 005 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.1 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 . . . . . . . . . . . . . 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 . 005 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 . 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 . . . . . . . . . . . . . 26.3 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 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.5 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 . . . . . 0.454 HD22 ' HA ' ' A' ' 101' ' ' ASN . 54.3 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 . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 91.5 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 . . . . . . . . . . . . . 67.0 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 . . . . . . . . . . . . . 45.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 87.2 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 . 006 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 . 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 . . . . . . . . . . . . . 82.8 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 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 14.9 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 . . . . . . . . . . . . . 99.3 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 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 29.0 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 . 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 . . . . . . . . . . . . . 97.5 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 . 006 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 . 006 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . 0.42 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 . 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 . . . . . 0.42 ' 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 . 006 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 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.5 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 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 51.9 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 97.7 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 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.7 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 . . . . . . . . . . . . . 71.2 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 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 99.3 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 76.1 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 . 006 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 . 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 . . . . . . . . . . . . . 86.0 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.492 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 . 006 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.4 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 . 006 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 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 95.1 mt -61.21 -36.5 73.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.803 0.335 . . . . 0.0 111.186 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.454 ' HA ' HD22 ' A' ' 7' ' ' LEU . 23.0 t-20 -64.09 -45.7 87.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.99 -43.15 73.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.194 179.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.239 -174.309 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.608 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 76.5 mt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.784 0.326 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.608 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.1 Cg_exo -60.89 -48.81 9.68 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.682 1.588 . . . . 0.0 111.214 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.4 ' HB3' ' HB3' ' A' ' 129' ' ' ALA . 36.4 mmt -61.65 -45.76 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 179.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.02 -46.82 87.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.196 -177.328 . . . . . . . . 1 1 . 1 . 006 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 119.671 -0.812 . . . . 0.0 111.873 -179.491 . . . . . . . . 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 . . . . . . . . . . . . . 93.3 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 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.4 ' HB3' ' 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 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 . . . . . . . . . . . . . 35.9 t30 -54.27 -44.26 71.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.31 -37.41 68.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.68 -20.19 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.244 -176.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.185 176.838 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo . . . . . 0 N--CA 1.458 -0.583 0 N-CA-C 111.206 -0.344 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -74.15 -45.08 51.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -71.47 -35.86 70.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.67 -35.53 72.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.259 178.61 . . . . . . . . 1 1 . 1 . 006 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 116.175 -0.466 . . . . 0.0 112.157 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 75.2 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 . 006 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 25.2 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 . . . . . . . . . . . . . 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 . 006 nuclear orig core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 34.2 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.457 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 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.5 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 16.3 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 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.0 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 . . . . . . . . 1 1 . 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 . . . . . . . . . . . . . 94.2 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 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.2 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 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.7 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 . 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 . . . . . . . . . . . . . 45.7 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 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.8 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 . . . . . . . . . . . . . 87.2 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 . 007 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 . 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 . . . . . . . . . . . . . 41.5 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 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 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 . . . . . . . . . . . . . 70.8 mm-40 -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 . . . . . . . . . . . . . 30.3 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 . . . . . . . . . . . . . 85.2 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 . 007 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 81.2 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 . . . . . . . . . . . . . 63.7 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 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 12.6 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 . 007 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 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 77.2 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 . . . . . 0.503 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 . 007 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 . 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 . . . . . . . . . . . . . 40.4 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 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 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 . . . . . . . . . . . . . 63.0 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 . 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 72.0 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 . 007 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 . 007 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 . 007 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 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 69.6 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 91.9 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 77.1 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 . 007 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 007 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 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 97.1 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 . 007 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.457 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -57.07 -34.97 46.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -76.1 -39.27 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.194 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -62.09 -27.36 68.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.199 173.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.462 ' O ' HG12 ' A' ' 103' ' ' VAL . 38.2 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.213 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.586 ' HB2' ' HD3' ' A' ' 119' ' ' PRO . 69.4 mt . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.805 0.336 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 118' ' ' LEU . 83.7 Cg_exo -52.54 -47.93 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.705 1.603 . . . . 0.0 111.242 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.09 -31.36 30.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.2 -173.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.9 mt -55.96 -52.12 65.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.202 174.533 . . . . . . . . 1 1 . 1 . 007 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 119.671 -0.812 . . . . 0.0 111.873 -177.718 . . . . . . . . 1 1 . 1 . 007 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 . 007 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 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 21.1 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 . . . . . . . . . . . . . 50.3 mt-10 -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 . . . . . . . . . . . . . 54.9 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 . . . . . . . . . . . . . 94.7 m-20 -58.07 -42.1 84.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.11 -36.3 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.184 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.93 -24.6 66.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.203 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 179.828 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo . . . . . 0 N--CA 1.458 -0.6 0 N-CA-C 111.178 -0.355 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -50.81 25.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.231 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.4 ttm105 -68.16 -33.44 74.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.225 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.95 -35.65 57.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.157 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 74.7 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 . . . . . . . . . . . . . 94.4 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 . . . . . . . . . . . . . 4.5 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 . . . . . . . . . . . . . 81.9 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 . 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 . . . . . . . . . . . . . 59.8 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 . . . . . . . . . . . . . 90.6 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 . 007 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 . 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 . . . . . . . . . . . . . 96.6 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 . 007 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 . 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 . . . . . . . . . . . . . 51.7 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 . 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 . . . . . . . . . . . . . 11.6 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 . . . . . . . . . . . . . 82.9 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 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.8 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 . 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 . . . . . . . . . . . . . 45.7 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 . 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 . . . . . . . . . . . . . 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 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.9 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 . . . . . . . . . . . . . 70.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 89.2 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 . 008 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 . 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 . . . . . . . . . . . . . 66.5 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 . . . . . . . . . . . . . 86.6 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 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.5 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 . . . . . . . . . . . . . 15.0 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 . . . . . . . . . . . . . 99.4 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 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.6 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 77.0 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 . . . . . 0.503 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 . 008 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 . 008 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 . 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 . . . . . 0.422 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 . 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 . . . . . 0.422 ' 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 . 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 . . . . . . . . . . . . . 32.4 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 . . . . . . . . . . . . . 51.9 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 . 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 . . . . . 0.4 HD11 HD12 ' A' ' 50' ' ' ILE . 72.5 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.6 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 76.8 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 . 008 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 . 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 . . . . . . . . . . . . . 94.2 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 . . . . . . . . . . . . . 95.2 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 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.3 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 . 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 . . . . . . . . . . . . . 58.9 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 . 008 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 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.453 HG22 ' HB3' ' A' ' 118' ' ' LEU . 68.8 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 . 008 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.1 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 . 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 . . . . . . . . . . . . . 57.7 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 . . . . . . . . . . . . . 97.1 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.0 mt -60.21 -30.92 46.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.188 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -75.15 -34.78 61.65 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.743 0.417 . . . . 0.0 111.19 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.6 mmm -68.68 -21.21 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.222 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -177.34 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.6 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 50.5 Cg_exo -56.0 -50.13 13.31 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 121.739 1.626 . . . . 0.0 111.221 174.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.9 mmt -61.49 -43.12 99.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.58 -47.22 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.191 179.517 . . . . . . . . 1 1 . 1 . 008 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 119.671 -0.812 . . . . 0.0 111.873 -178.971 . . . . . . . . 1 1 . 1 . 008 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 . 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 . . . . . . . . . . . . . 81.6 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 . . . . . . . . . . . . . 19.9 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 . 008 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 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.464 ' C ' HD21 ' A' ' 132' ' ' ASN . 0.2 OUTLIER -48.95 -46.19 42.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.19 -38.58 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.167 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.84 -23.27 67.29 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 123.944 0.897 . . . . 0.0 111.205 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.198 -178.632 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo . . . . . 0 N--CA 1.458 -0.592 0 N-CA-C 111.189 -0.35 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -74.68 -48.78 24.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.232 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -74.18 -37.2 64.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 176.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.36 -41.47 98.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.234 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.157 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 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 . 008 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.1 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 . . . . . . . . . . . . . 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 . 008 nuclear orig core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.7 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.7 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 . 008 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' 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 . . . . . . . . 2 2 . 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 . . . . . . . . . . . . . 26.3 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 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.444 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 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 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 . 009 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 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.2 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 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.5 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 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 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 47.1 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . 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 . 009 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 . 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 . . . . . 0.423 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 . . . . . 0.423 ' 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 . . . . . . . . . . . . . 42.9 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 71.3 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 . . . . . . . . . . . . . 38.0 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 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 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 . . . . . . . . . . . . . 97.7 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 74.4 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 . 009 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 . 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 . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.5 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 70.4 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 . 009 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.9 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 . . . . . . . . . . . . . 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 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 95.6 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.7 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 . 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 . . . . . 0.444 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.53 -34.87 48.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -74.74 -33.53 62.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.137 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 90.9 mmm -72.32 -14.39 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.191 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.227 -178.292 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.609 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 60.8 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.774 0.321 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.5 Cg_exo -59.62 -41.5 55.64 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 121.711 1.607 . . . . 0.0 111.198 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -71.98 -42.39 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.202 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.19 -48.71 80.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.16 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.873 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 93.4 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 . 009 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 . 009 nuclear orig core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 55.6 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 . . . . . . . . . . . . . 88.3 m-20 -56.49 -39.5 73.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.215 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.9 mt -73.89 -41.52 62.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.204 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.59 -32.54 71.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.222 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.224 -177.162 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 N--CA 1.458 -0.585 0 N-CA-C 111.186 -0.352 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.46 -53.61 9.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.186 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -61.8 -43.39 98.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.235 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.66 95.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.233 178.49 . . . . . . . . 1 1 . 1 . 009 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 116.178 -0.464 . . . . 0.0 112.157 179.164 . . . . . . . . 1 1 . 1 . 009 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 . 009 nuclear orig core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.5 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 . 009 nuclear orig core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.6 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 . 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 . . . . . . . . . . . . . 5.6 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 40.1 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.477 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 . . . . . . . . . . . . . 51.6 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 . 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 . . . . . . . . . . . . . 25.1 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 . . . . . 0.484 HD22 ' HA ' ' A' ' 101' ' ' ASN . 95.6 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 . 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 . . . . . . . . . . . . . 94.5 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 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.6 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 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.5 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 . . . . . . . . . . . . . 41.8 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 . 010 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 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 88.4 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 . 010 nuclear orig 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 . 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 . . . . . . . . . . . . . 66.4 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 15.1 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 . . . . . . . . . . . . . 99.4 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 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.1 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 . 010 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 . 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 . . . . . . . . . . . . . 77.0 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 . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.3 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 . . . . . . . . . . . . . 85.0 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 . . . . . . . . . . . . . 27.6 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 . 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 . . . . . 0.42 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 . 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 . . . . . 0.42 ' 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 52.3 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 . . . . . . . . . . . . . 71.2 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 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 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 . . . . . . . . . . . . . 45.6 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 . 010 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 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 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 . . . . . . . . . . . . . 90.8 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 . 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 . . . . . . . . . . . . . 33.0 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 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.6 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.431 HG22 HD23 ' A' ' 118' ' ' LEU . 69.9 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 . . . . . . . . . . . . . 73.8 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 . 010 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 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 83.6 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 . . . . . . . . . . . . . 84.6 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 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.6 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 . . . . . 0.477 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.41 -46.28 81.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.19 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASN . . . . . 0.484 ' HA ' HD22 ' A' ' 7' ' ' LEU . 13.7 t-20 -59.39 -44.88 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.215 175.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.3 tpp -57.88 -32.77 68.01 Favored 'General case' 0 C--N 1.275 -2.645 0 C-N-CA 125.197 1.399 . . . . 0.0 111.15 -174.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.6 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.542 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.585 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 42.2 mt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.8 0.333 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 61.9 Cg_exo -58.61 -43.28 46.34 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 121.655 1.57 . . . . 0.0 111.212 -178.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.1 mmt -67.24 -42.7 83.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.171 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.42 -46.93 88.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.174 179.624 . . . . . . . . 1 1 . 1 . 010 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 119.671 -0.812 . . . . 0.0 111.873 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.1 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 . . . . . . . . . . . . . 82.2 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 . . . . . . . . . . . . . 19.6 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 . . . . . . . . . . . . . 77.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -65.34 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.32 -33.98 76.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.225 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.72 -14.25 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.207 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.162 -179.408 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 N--CA 1.458 -0.591 0 N-CA-C 111.235 -0.333 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.05 -28.06 69.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.231 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -99.84 -39.45 8.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.209 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.48 -35.06 79.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -169.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.157 178.147 . . . . . . . . 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 . . . . . . . . . . . . . 88.2 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 . 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 . . . . . . . . . . . . . 17.1 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 . . . . . . . . . . . . . 35.6 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 . . . . . . . . . . . . . 89.5 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 . 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 . . . . . . . . . . . . . 96.0 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 . . . . . 0.404 ' HD3' ' HA ' ' 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 . . . . . . . . 2 2 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . . . . . . . . . 26.2 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 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.469 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 . . . . . . . . . . . . . 55.1 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 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 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 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.1 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 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.7 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 . 001 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 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 93.9 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 . . . . . . . . . . . . . 88.4 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 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 44.4 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 . . . . . . . . . . . . . 78.7 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 . . . . . . . . . . . . . 90.4 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 . 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 . . . . . . . . . . . . . 87.3 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 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 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 88.5 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 . 001 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 . 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 . . . . . . . . . . . . . 60.5 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 . . . . . . . . . . . . . 86.4 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 . . . . . . . . . . . . . 63.4 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 . . . . . . . . . . . . . 89.5 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 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 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 . 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 . . . . . . . . . . . . . 41.0 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.4 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 . . . . . 0.504 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 . 001 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 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 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 . . . . . 0.424 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 . 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 . . . . . 0.424 ' 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 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.8 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 . . . . . . . . . . . . . 43.1 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 . 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 . . . . . . . . . . . . . 62.5 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 . 001 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 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 89.5 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 . . . . . . . . . . . . . 97.0 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 . . . . . . . . . . . . . 64.9 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 . . . . . 0.4 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 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.9 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 . 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 . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 001 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 . 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 . . . . . . . . . . . . . 79.6 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 . . . . . . . . . . . . . 93.0 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 . . . . . . . . . . . . . 32.3 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 . 001 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 . 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 . . . . . . . . . . . . . 99.7 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 . . . . . . . . . . . . . 97.6 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 . . . . . . . . . . . . . 58.5 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 . . . . . 0.464 HG22 ' HB3' ' A' ' 118' ' ' LEU . 70.7 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 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 59.0 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 . . . . . . . . . . . . . 96.2 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 . 001 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 . 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 . . . . . . . . . . . . . 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 . 001 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 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.5 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 . 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 . . . . . 0.469 HG21 HG12 ' A' ' 3' ' ' ILE . 96.7 mt -55.66 -39.67 56.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.764 0.316 . . . . 0.0 111.186 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -66.75 -47.0 73.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.141 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.0 mmm -61.72 -25.92 67.73 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.217 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 103' ' ' VAL . 44.4 t -95.04 -12.35 8.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -73.78 103.73 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.198 -172.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 55.25 34.85 23.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.184 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 59.2 tpp -87.46 147.08 25.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.04 162.64 48.68 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.31 -35.08 79.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 111.185 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.9 m -70.65 -40.47 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.172 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.97 -45.37 95.27 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 174.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.0 t -65.22 -42.77 94.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 111.22 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.06 81.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.175 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.84 -34.71 71.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.206 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -66.79 -36.26 81.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.196 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 83.6 m -57.59 -33.7 68.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.183 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.39 -19.88 64.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.168 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 71.2 m -100.65 -0.73 36.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.197 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.561 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.5 mt -64.89 -40.97 51.94 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.197 -175.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 71.4 Cg_exo -56.05 -41.94 71.79 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.678 1.585 . . . . 0.0 111.25 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.46 ' HB3' ' HB3' ' A' ' 129' ' ' ALA . 36.1 mmt -65.77 -42.96 90.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.195 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.32 -51.14 70.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.15 176.83 . . . . . . . . 1 1 . 1 . 001 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 119.671 -0.812 . . . . 0.0 111.873 -174.575 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 001 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 . 001 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 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.46 ' HB3' ' 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 . 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 . . . . . . . . . . . . . 53.3 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 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -65.65 -32.8 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.223 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.28 -34.3 74.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.193 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.16 -15.97 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.238 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -83.41 -8.75 59.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.1 p -74.25 161.08 30.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.216 -171.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -65.1 -34.75 79.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.212 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -54.4 -42.32 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.196 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -66.64 -42.35 86.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.195 -178.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -61.11 -39.89 91.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.173 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -73.87 -48.61 29.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.213 -177.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 44.7 p -134.35 81.94 48.08 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.219 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -58.94 -34.81 99.28 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 121.682 1.588 . . . . 0.0 111.212 -174.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -69.54 -50.61 43.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.165 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.11 -36.59 84.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.791 0.329 . . . . 0.0 111.203 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.64 -41.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.216 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.157 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 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 . 001 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.4 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 . . . . . . . . . . . . . 96.4 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 . 001 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 17.0 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 . 001 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.4 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 . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 70.9 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 . 001 nuclear orig full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.7 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 . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 41.7 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 . . . . . . . . . . . . . 26.2 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 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.497 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 . 002 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 . 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 . . . . . . . . . . . . . 11.4 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 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 101' ' ' ASN . 84.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.5 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 . . . . . . . . . . . . . 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 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.0 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 . . . . . . . . . . . . . 64.0 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . 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 . 002 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 . 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 . 49.5 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 . 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 . 54.6 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 . 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 . . . . . . . . . . . . . 48.1 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 25.3 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 93.2 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 99.4 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 . 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 . . . . . . . . . . . . . 58.8 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 . 002 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 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.442 HG22 ' HB3' ' A' ' 118' ' ' LEU . 73.1 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 . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 002 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 002 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 . 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 . . . . . 0.497 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -55.51 -40.45 58.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.769 0.319 . . . . 0.0 111.192 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.412 ' HA ' HD22 ' A' ' 7' ' ' LEU . 52.2 t-20 -65.66 -41.11 92.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.239 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 97.0 mmm -63.79 -33.57 75.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 63.7 t -86.58 -17.92 8.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.235 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -71.9 75.05 0.89 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 49.35 56.36 7.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 172.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 63.3 tpp -95.71 -14.28 23.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.71 164.57 24.26 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.29 -33.4 75.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.799 0.333 . . . . 0.0 111.222 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 96.4 m -64.63 -41.88 95.87 Favored 'General case' 0 N--CA 1.457 -0.083 0 O-C-N 122.137 -0.352 . . . . 0.0 111.221 177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.98 -41.72 93.07 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.48 -43.95 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.799 0.333 . . . . 0.0 111.176 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.13 83.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -68.47 -39.41 81.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.9 m -58.99 -37.38 76.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.193 178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -66.05 -24.66 66.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.181 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p -102.56 3.91 37.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.198 -171.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.601 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 51.1 mt -67.84 -39.92 20.87 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.221 -173.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 49.3 Cg_exo -62.48 -44.32 18.59 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.644 1.563 . . . . 0.0 111.233 -178.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 34.9 mmt -65.96 -40.93 91.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.206 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -59.15 -49.74 76.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.232 176.309 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.717 . . . . . . . . 1 1 . 1 . 002 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 . 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 . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -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 . . . . . . . . . . . . . 53.1 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 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.92 -41.36 64.35 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 . . . . . . . . . . . . . 83.1 mt -75.38 -37.29 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.15 65.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.199 -176.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -98.28 11.46 37.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 58.0 m -94.63 161.93 14.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.229 178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -60.34 -31.7 70.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.238 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -56.25 -52.96 62.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.192 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -62.71 -35.61 80.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.202 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -66.88 -26.86 67.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.193 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -84.45 -45.35 12.77 Favored 'General case' 0 C--N 1.395 2.547 0 O-C-N 119.583 -1.948 . . . . 0.0 111.17 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 43.7 p -131.65 73.14 79.57 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.217 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.21 -23.29 45.53 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 121.721 1.614 . . . . 0.0 111.199 -176.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -76.1 -48.11 21.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.193 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -74.4 -35.76 63.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.203 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.3 88.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.204 -179.772 . . . . . . . . 1 1 . 1 . 002 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 116.187 -0.461 . . . . 0.0 112.157 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 65.7 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 . . . . . . . . . . . . . 84.0 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 . . . . . . . . . . . . . 83.2 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 . 002 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 . 002 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.2 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 . . . . . . . . . . . . . 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 . 002 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 43.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 96.6 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 . 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.2 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 . 003 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 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 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 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.2 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 . . . . . . . . . . . . . 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 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 79.1 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 . . . . . . . . . . . . . 90.6 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 . 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 . . . . . . . . . . . . . 87.2 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.4 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 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 90.3 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 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 . 003 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 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.0 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 . . . . . . . . . . . . . 99.3 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 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.9 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 . 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 . . . . . . . . . . . . . 29.1 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 . 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 . . . . . . . . . . . . . 48.1 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 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.9 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 . . . . . 0.504 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 . 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 . . . . . . . . . . . . . 27.4 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 . . . . . 0.42 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 . 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 . . . . . 0.42 ' 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 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.1 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 . . . . . . . . . . . . . 40.7 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 . . . . . . . . . . . . . 2.9 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 . . . . . . . . . . . . . 90.1 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 . 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 . . . . . . . . . . . . . 68.8 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 64.4 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 . . . . . 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 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.4 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 . . . . . . . . . . . . . 45.6 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 . 003 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 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.5 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . 0.47 HG22 ' HB3' ' A' ' 118' ' ' LEU . 77.0 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 . . . . . . . . . . . . . 72.2 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 . 003 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 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 93.0 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 . 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 . . . . . 0.419 ' O ' ' HB2' ' A' ' 104' ' ' PHE . 96.3 mt -59.52 -30.04 43.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.815 0.34 . . . . 0.0 111.199 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -77.0 -39.27 51.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 177.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 93.1 mmm -60.99 -44.7 97.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.218 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.4 m -77.24 -18.47 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.233 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 100' ' ' ILE . 63.9 t80 -67.76 83.29 0.19 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.214 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 44.62 66.0 0.96 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.146 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 57.4 ttm -115.23 -30.03 6.42 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 123.44 0.696 . . . . 0.0 111.16 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.33 147.83 5.94 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.19 -0.764 . . . . 0.0 111.19 -177.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.43 -32.38 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 111.198 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 79.0 p -74.06 -27.25 60.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.193 175.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -70.17 -40.17 71.65 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.6 t -68.92 -40.45 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.781 0.325 . . . . 0.0 111.187 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.77 -46.0 92.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.196 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.12 89.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -62.41 -35.29 78.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.227 174.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.401 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 96.2 m -64.78 -36.75 85.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.166 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -72.28 -11.25 60.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.225 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.0 m -114.98 15.8 17.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.156 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.591 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 49.2 mt -74.44 -39.24 3.76 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.591 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 75.4 Cg_exo -56.21 -43.4 56.49 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 121.708 1.605 . . . . 0.0 111.171 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.7 mmt -66.61 -38.32 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.184 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.04 -47.55 74.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.216 178.422 . . . . . . . . 1 1 . 1 . 003 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 119.671 -0.812 . . . . 0.0 111.873 179.722 . . . . . . . . 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 . . . . . . . . . . . . . 81.7 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 . 003 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 003 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 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -64.29 -34.44 78.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.206 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -73.81 -34.74 64.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.238 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -16.48 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.164 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -94.32 10.62 33.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.238 178.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 83.3 p -69.09 164.84 21.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -76.74 -35.89 57.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.222 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -65.6 -32.7 74.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.173 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -50.22 -35.1 25.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.154 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.8 -41.2 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.196 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -71.74 -48.76 44.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.186 -175.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.7 p -132.08 74.55 76.45 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.166 -178.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.74 -30.28 84.66 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 121.715 1.61 . . . . 0.0 111.167 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -70.78 -56.67 5.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.2 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -59.89 -45.15 93.44 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 125.05 1.34 . . . . 0.0 111.165 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -60.91 -43.39 98.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.219 177.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.157 176.966 . . . . . . . . 1 1 . 1 . 003 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 . 003 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.7 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 . . . . . . . . . . . . . 90.2 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 . 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 . . . . . . . . . . . . . 19.8 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 . . . . . . . . . . . . . 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 . 003 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.7 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 . 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 . . . . . . . . . . . . . 68.9 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 . . . . . . . . . . . . . 91.0 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 . . . . . . . . . . . . . 95.4 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 . . . . . . . . . . . . . 96.5 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 . . . . . 0.419 ' HD3' ' HA ' ' A' ' 162' ' ' LYS . 30.8 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 . . . . . . . . . . . . . 61.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.433 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 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.1 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 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 17.9 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 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 84.6 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 . 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 . . . . . . . . . . . . . 87.3 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 . 004 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 . 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 . . . . . . . . . . . . . 42.0 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 . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 69.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 90.0 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 . . . . . 0.503 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 . 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 . . . . . . . . . . . . . 65.5 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 . . . . . . . . . . . . . 85.6 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 . 004 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 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 87.8 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 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 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 . . . . . . . . . . . . . 44.6 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . 0.503 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 . 004 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 . 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 . . . . . 0.421 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 . 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 . . . . . 0.421 ' 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 . 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 . . . . . . . . . . . . . 31.2 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 . 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 . . . . . . . . . . . . . 50.8 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 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.7 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 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.3 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.6 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 . 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 . . . . . . . . . . . . . 25.4 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 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.4 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 . . . . . . . . . . . . . 69.0 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 95.2 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 . 004 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 . 004 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 . 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 . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 58.7 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 . . . . . 0.478 HG22 ' HB3' ' A' ' 118' ' ' LEU . 77.6 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 . . . . . . . . . . . . . 74.0 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 . . . . . . . . . . . . . 57.4 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 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 7.4 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.5 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 . . . . . 0.433 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -37.03 59.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.407 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 55.1 t-20 -76.6 -32.37 58.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.168 179.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 tpp -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.164 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.6 m -96.86 8.53 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.214 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -77.97 79.41 4.44 Favored 'General case' 0 C--N 1.4 2.772 0 O-C-N 120.637 -1.289 . . . . 0.0 111.221 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 55.17 45.36 26.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.203 174.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 55.1 ttm -86.13 -27.16 24.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.184 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.06 162.36 14.41 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.01 -41.7 97.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 111.225 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.9 m -58.33 -44.5 88.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.205 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.85 -44.2 97.8 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.1 t -64.01 -36.09 75.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 111.178 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.33 -50.19 74.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.229 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.71 -36.98 83.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.179 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -63.88 -35.82 81.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.192 178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.47 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 76.9 m -61.04 -34.39 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.239 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.62 -9.3 58.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.224 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.0 m -111.9 8.91 20.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.574 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 47.8 mt -72.03 -40.82 8.15 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.198 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 53.2 Cg_exo -57.37 -42.54 60.83 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.714 1.609 . . . . 0.0 111.207 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -64.91 -43.2 93.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.192 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.68 -47.93 84.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.206 177.061 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -176.649 . . . . . . . . 1 1 . 1 . 004 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 . 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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -61.61 -35.96 79.36 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 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.36 -33.71 67.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 -176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.64 62.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.19 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -84.24 -0.0 50.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 72.3 p -73.8 163.85 27.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.191 -176.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 80.8 ttt180 -70.61 -41.31 72.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.205 176.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -54.24 -40.99 68.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -61.26 -29.02 69.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -38.33 78.68 Favored 'General case' 1 C--N 1.433 4.201 0 O-C-N 119.236 -2.165 . . . . 0.0 111.203 -179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -85.53 -39.5 17.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.235 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.9 p -132.49 74.8 74.85 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.195 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.05 -28.94 48.98 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 121.673 1.582 . . . . 0.0 111.222 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.75 -49.48 38.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.238 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -69.66 -37.73 76.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.173 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.75 -37.46 82.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.197 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.9 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 . . . . 0.0 112.157 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 96.3 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 . 004 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.3 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 . 004 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 . 004 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.3 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 . . . . . . . . . . . . . 30.8 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 96.7 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 . 004 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' 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 . . . . . . . . 2 2 . 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 . . . . . . . . . . . . . 41.7 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 . . . . . 0.423 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 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.0 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 9.9 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 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.2 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 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.9 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 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.6 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 . 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 . . . . . . . . . . . . . 78.9 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 . . . . . . . . . . . . . 87.3 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 . 005 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 80.9 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 . . . . . . . . . . . . . 58.6 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 . 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 86.5 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.5 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 87.7 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 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.5 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 . . . . . . . . . . . . . 41.4 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 . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 84.5 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 . 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 . . . . . 0.422 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 . 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 . . . . . 0.422 ' 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 . 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 . . . . . . . . . . . . . 43.7 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 . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 62.5 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 . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.8 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 . 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 . . . . . . . . . . . . . 99.8 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.0 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 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 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.5 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 . 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 . . . . . . . . . . . . . 58.8 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 . 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 . . . . . . . . . . . . . 7.3 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 . 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 . . . . . . . . . . . . . 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 . 005 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 orig full ' A' A ' 99' ' ' ALA . . . . . 0.402 ' O ' HG23 ' A' ' 103' ' ' VAL . . . -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 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.423 HG21 HG12 ' A' ' 3' ' ' ILE . 96.2 mt -58.08 -29.24 36.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.788 0.327 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -78.99 -35.59 42.66 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 125.358 1.463 . . . . 0.0 111.212 178.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.2 mmm -70.98 -15.14 62.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.216 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 99' ' ' ALA . 25.6 m -120.81 11.45 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -80.53 73.34 7.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.197 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 57.47 37.82 27.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.216 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 56.9 tpp -71.33 -28.65 64.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.122 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.5 155.01 23.18 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.0 -37.17 78.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 0.0 111.232 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 97.9 m -63.43 -42.35 98.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.196 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.89 -42.65 96.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 64.1 t -60.52 -43.09 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.753 0.311 . . . . 0.0 111.182 178.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.29 -35.06 68.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.215 -173.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.66 -37.64 88.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.217 169.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.32 -34.78 76.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.18 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.7 m -62.86 -33.85 76.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -176.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.7 -26.72 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.2 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.7 m -101.01 3.42 41.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.195 -168.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.551 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 71.4 mt -66.67 -40.57 32.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.216 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 98.2 Cg_exo -50.33 -46.06 30.89 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.739 1.626 . . . . 0.0 111.185 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.2 mmt -66.05 -41.88 90.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.78 -47.89 83.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.23 -179.287 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.758 . . . . . . . . 1 1 . 1 . 005 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 . 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 . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 94.7 m-20 -65.97 -34.95 79.29 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 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.43 -31.39 67.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 177.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.0 -14.69 63.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.205 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -92.44 7.32 43.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.264 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 76.9 p -73.23 160.84 31.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.228 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -70.42 -34.94 73.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.191 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -65.58 -35.15 80.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.188 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -55.83 -47.43 77.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.21 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -65.67 -35.43 80.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.206 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -67.87 -47.32 69.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.198 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 55.2 p -134.47 79.91 52.96 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.195 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -60.79 -38.57 69.54 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.704 1.602 . . . . 0.0 111.245 -173.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -66.17 -53.48 36.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.158 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.31 -64.49 0.85 Allowed 'General case' 0 C--N 1.319 -0.757 0 O-C-N 122.01 -0.431 . . . . 0.0 111.19 175.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -44.37 -44.0 7.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.243 178.778 . . . . . . . . 1 1 . 1 . 005 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 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 005 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 . 005 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 . 005 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 19.1 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 . 005 nuclear orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.2 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 . . . . . . . . . . . . . 82.1 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 . . . . . . . . . . . . . 53.8 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 . . . . . . . . . . . . . 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 . 005 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.1 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 . . . . . . . . . . . . . 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 . 005 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 . 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 . . . . . . . . . . . . . 26.3 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 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.5 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 . . . . . 0.454 HD22 ' HA ' ' A' ' 101' ' ' ASN . 54.3 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 . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 91.5 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 . . . . . . . . . . . . . 67.0 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 . . . . . . . . . . . . . 45.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 87.2 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 . 006 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 . 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 . . . . . . . . . . . . . 82.8 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 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 14.9 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 . . . . . . . . . . . . . 99.3 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 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 29.0 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 . 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 . . . . . . . . . . . . . 97.5 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 . 006 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 . 006 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . 0.42 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 . 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 . . . . . 0.42 ' 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 . 006 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 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.5 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 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 51.9 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 97.7 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 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.7 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 . . . . . . . . . . . . . 71.2 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 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 99.3 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 76.1 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 . 006 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 . 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 . . . . . . . . . . . . . 86.0 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.492 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 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.4 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 . 006 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 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 95.1 mt -61.21 -36.5 73.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.803 0.335 . . . . 0.0 111.186 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.454 ' HA ' HD22 ' A' ' 7' ' ' LEU . 23.0 t-20 -64.09 -45.7 87.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.99 -43.15 73.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.194 179.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.4 m -100.83 20.64 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.239 -174.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -75.35 -40.98 57.63 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 117.809 -1.556 . . . . 0.0 111.182 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -80.81 -20.05 43.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 172.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 54.0 mtt 56.43 38.29 29.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.51 154.48 45.77 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -176.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.27 -44.62 87.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.82 0.343 . . . . 0.0 111.216 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 98.7 m -69.32 -40.19 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.22 -48.87 75.71 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.45 -43.2 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.849 0.357 . . . . 0.0 111.211 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.06 -46.86 88.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.203 -177.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.24 84.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.218 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.08 -34.61 78.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 -177.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.421 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 76.6 m -66.65 -26.34 67.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.148 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -85.81 -8.33 58.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.244 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 83.1 p -99.63 -0.62 39.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.608 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 76.5 mt -68.71 -39.17 13.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -170.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.608 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.1 Cg_exo -60.89 -48.81 9.68 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.682 1.588 . . . . 0.0 111.214 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.4 ' HB3' ' HB3' ' A' ' 129' ' ' ALA . 36.4 mmt -61.65 -45.76 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 179.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.02 -46.82 87.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.196 -177.328 . . . . . . . . 1 1 . 1 . 006 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 119.671 -0.812 . . . . 0.0 111.873 -179.491 . . . . . . . . 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 . . . . . . . . . . . . . 93.3 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 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.4 ' HB3' ' 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 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 . . . . . . . . . . . . . 35.9 t30 -54.27 -44.26 71.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.31 -37.41 68.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.68 -20.19 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.244 -176.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.05 6.13 45.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.185 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.2 m -90.18 166.2 13.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.176 176.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.84 -36.91 84.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.194 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -53.61 -38.7 64.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -73.27 -26.48 61.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.174 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -75.91 -30.68 58.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.201 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -84.88 -38.07 19.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.19 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 72.4 p -132.95 72.17 77.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -73.38 -33.22 7.26 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 121.266 1.31 . . . . 0.0 111.206 -169.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -74.15 -45.08 51.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -71.47 -35.86 70.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.67 -35.53 72.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.259 178.61 . . . . . . . . 1 1 . 1 . 006 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 116.175 -0.466 . . . . 0.0 112.157 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 75.2 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 . 006 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 25.2 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 . . . . . . . . . . . . . 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 . 006 nuclear orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 34.2 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.457 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 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.5 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 16.3 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 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.0 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 . . . . . . . . 1 1 . 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 . . . . . . . . . . . . . 94.2 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 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.2 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 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.7 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 . 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 . . . . . . . . . . . . . 45.7 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 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.8 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 . . . . . . . . . . . . . 87.2 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 . 007 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 . 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 . . . . . . . . . . . . . 41.5 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 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 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 . . . . . . . . . . . . . 70.8 mm-40 -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 . . . . . . . . . . . . . 30.3 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 . . . . . . . . . . . . . 85.2 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 . 007 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 81.2 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 . . . . . . . . . . . . . 63.7 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 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 12.6 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 . 007 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 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 77.2 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 . . . . . 0.503 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 . 007 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 . 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 . . . . . . . . . . . . . 40.4 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 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 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 . . . . . . . . . . . . . 63.0 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 . 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 72.0 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 . 007 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 . 007 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 . 007 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 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 69.6 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 91.9 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 77.1 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 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 007 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 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 97.1 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 . 007 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.457 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -57.07 -34.97 46.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -76.1 -39.27 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.194 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -62.09 -27.36 68.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.199 173.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.462 ' O ' HG12 ' A' ' 103' ' ' VAL . 38.2 t -92.47 -12.93 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.213 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -78.54 70.26 4.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.156 -168.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 49.29 54.69 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.226 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 37.8 mmt -86.09 -18.39 32.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.208 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.73 -173.47 28.26 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -177.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.49 -38.26 74.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -166.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 76.2 p -73.19 -30.77 63.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.195 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.76 -44.37 89.54 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.0 t -65.01 -45.29 95.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.0 111.212 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.21 -46.15 91.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.194 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.37 90.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.162 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -53.9 -47.44 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.228 175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.1 m -59.5 -40.54 87.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.187 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -53.7 -33.92 57.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 97.4 p -97.0 -5.3 38.06 Favored 'General case' 0 C--N 1.337 0.064 0 O-C-N 121.226 -0.921 . . . . 0.0 111.238 -166.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.586 ' HB2' ' HD3' ' A' ' 119' ' ' PRO . 69.4 mt -64.02 -41.95 66.04 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.203 -170.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 118' ' ' LEU . 83.7 Cg_exo -52.54 -47.93 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.705 1.603 . . . . 0.0 111.242 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.09 -31.36 30.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.2 -173.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.9 mt -55.96 -52.12 65.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.202 174.533 . . . . . . . . 1 1 . 1 . 007 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 119.671 -0.812 . . . . 0.0 111.873 -177.718 . . . . . . . . 1 1 . 1 . 007 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 . 007 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 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 21.1 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 . . . . . . . . . . . . . 50.3 mt-10 -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 . . . . . . . . . . . . . 54.9 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 . . . . . . . . . . . . . 94.7 m-20 -58.07 -42.1 84.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.11 -36.3 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.184 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.93 -24.6 66.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.203 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -93.22 4.61 53.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.9 m -85.5 166.22 16.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.176 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.38 -36.47 83.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.235 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 53.8 t-105 -55.33 -46.04 76.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.187 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -67.52 -38.8 84.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.215 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -62.62 -31.24 72.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.205 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -85.21 -50.7 7.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.224 -177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.8 p -128.14 77.88 76.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.239 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -72.12 -26.92 17.55 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 121.735 1.623 . . . . 0.0 111.178 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -50.81 25.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.231 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.4 ttm105 -68.16 -33.44 74.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.225 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.95 -35.65 57.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.157 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 74.7 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 . . . . . . . . . . . . . 94.4 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 . . . . . . . . . . . . . 4.5 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 . . . . . . . . . . . . . 81.9 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 . 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 . . . . . . . . . . . . . 59.8 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 . . . . . . . . . . . . . 90.6 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 . 007 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 . 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 . . . . . . . . . . . . . 96.6 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 . 007 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 . 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 . . . . . . . . . . . . . 51.7 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 . 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 . . . . . . . . . . . . . 11.6 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 . . . . . . . . . . . . . 82.9 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 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.8 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 . 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 . . . . . . . . . . . . . 45.7 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 . 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 . . . . . . . . . . . . . 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 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.9 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 . . . . . . . . . . . . . 70.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 89.2 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 . 008 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 . 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 . . . . . . . . . . . . . 66.5 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 . . . . . . . . . . . . . 86.6 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 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.5 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 . . . . . . . . . . . . . 15.0 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 . . . . . . . . . . . . . 99.4 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 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.6 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 77.0 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 . . . . . 0.503 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 . 008 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 . 008 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 . 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 . . . . . 0.422 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 . 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 . . . . . 0.422 ' 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 . 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 . . . . . . . . . . . . . 32.4 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 . . . . . . . . . . . . . 51.9 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 . 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 . . . . . 0.4 HD11 HD12 ' A' ' 50' ' ' ILE . 72.5 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.6 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 76.8 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 . 008 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 . 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 . . . . . . . . . . . . . 94.2 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 . . . . . . . . . . . . . 95.2 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 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.3 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 . 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 . . . . . . . . . . . . . 58.9 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 . 008 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 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.453 HG22 ' HB3' ' A' ' 118' ' ' LEU . 68.8 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 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.1 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 . 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 . . . . . . . . . . . . . 57.7 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 . . . . . . . . . . . . . 97.1 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.0 mt -60.21 -30.92 46.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.188 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -75.15 -34.78 61.65 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.743 0.417 . . . . 0.0 111.19 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.6 mmm -68.68 -21.21 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.222 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.6 t -103.23 -27.11 3.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -63.28 100.12 0.22 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.214 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 52.06 41.48 29.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.202 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 61.0 tpp -90.92 139.9 30.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.194 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -73.23 172.3 50.16 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.796 0.331 . . . . 0.0 111.222 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 94.8 m -59.13 -45.68 90.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.03 -37.08 60.4 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 66.8 t -63.28 -45.86 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.17 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.89 -50.38 72.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.217 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.76 -34.75 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -67.99 -39.32 83.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.175 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.6 m -61.75 -32.04 72.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.184 178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -72.19 -15.15 61.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.187 -177.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 79.8 p -116.16 9.42 14.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 -176.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.6 mt -68.57 -40.7 19.7 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.187 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 50.5 Cg_exo -56.0 -50.13 13.31 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 121.739 1.626 . . . . 0.0 111.221 174.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.9 mmt -61.49 -43.12 99.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.58 -47.22 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.191 179.517 . . . . . . . . 1 1 . 1 . 008 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 119.671 -0.812 . . . . 0.0 111.873 -178.971 . . . . . . . . 1 1 . 1 . 008 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 . 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 . . . . . . . . . . . . . 81.6 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 . . . . . . . . . . . . . 19.9 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 . 008 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 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.464 ' C ' HD21 ' A' ' 132' ' ' ASN . 0.2 OUTLIER -48.95 -46.19 42.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.19 -38.58 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.167 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.84 -23.27 67.29 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 123.944 0.897 . . . . 0.0 111.205 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -100.15 11.35 39.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.198 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.7 m -104.97 163.43 12.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.188 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -57.96 -38.24 75.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.237 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -53.58 -52.28 60.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.226 -177.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -64.3 -39.46 93.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.221 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -57.31 -39.06 75.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.23 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -76.0 -46.07 31.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.207 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.9 p -131.54 72.13 80.7 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.201 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -73.68 -23.97 16.3 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 121.701 1.601 . . . . 0.0 111.189 -168.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -74.68 -48.78 24.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.232 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -74.18 -37.2 64.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 176.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.36 -41.47 98.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.234 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.157 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 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 . 008 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.1 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 . . . . . . . . . . . . . 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 . 008 nuclear orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.7 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.7 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 . 008 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' 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 . . . . . . . . 2 2 . 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 . . . . . . . . . . . . . 26.3 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 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.444 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 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 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 . 009 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 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.2 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 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.5 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 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 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 47.1 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . 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 . 009 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 . 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 . . . . . 0.423 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 . . . . . 0.423 ' 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 . . . . . . . . . . . . . 42.9 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 71.3 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 . . . . . . . . . . . . . 38.0 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 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 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 . . . . . . . . . . . . . 97.7 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 74.4 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 . 009 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 . 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 . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.5 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 70.4 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 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.9 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 . . . . . . . . . . . . . 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 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 95.6 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.7 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 . 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 . . . . . 0.444 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.53 -34.87 48.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -74.74 -33.53 62.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.137 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 90.9 mmm -72.32 -14.39 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.191 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 70.9 t -111.34 -22.44 4.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.227 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.63 101.22 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.204 -178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 57.96 32.25 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.211 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 48.7 tpp -78.72 150.07 32.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.212 173.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.24 -168.98 44.87 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 174.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -74.63 -41.78 59.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.324 . . . . 0.0 111.189 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.7 m -65.55 -39.32 91.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.198 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.02 -45.57 93.59 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.5 t -64.32 -41.54 92.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.821 0.343 . . . . 0.0 111.207 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.54 -41.04 98.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.182 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.65 -50.21 73.92 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 120.988 -1.07 . . . . 0.0 111.185 170.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.13 -33.65 72.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.187 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.449 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 86.6 m -65.76 -26.89 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.217 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.75 -19.93 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.198 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 93.7 p -107.03 3.81 26.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.199 -173.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.609 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 60.8 mt -67.78 -39.11 16.91 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.5 Cg_exo -59.62 -41.5 55.64 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 121.711 1.607 . . . . 0.0 111.198 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -71.98 -42.39 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.202 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.19 -48.71 80.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.16 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.873 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 93.4 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 . 009 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 . 009 nuclear orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 55.6 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 . . . . . . . . . . . . . 88.3 m-20 -56.49 -39.5 73.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.215 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.9 mt -73.89 -41.52 62.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.204 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.59 -32.54 71.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.222 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -89.94 2.83 54.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.224 -177.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 69.8 m -85.84 166.28 16.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.178 175.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.84 -33.43 75.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 39.4 t-105 -54.26 -44.71 72.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.217 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -63.34 -42.76 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.23 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -64.04 -34.36 77.84 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -68.23 -49.53 60.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.192 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 43.9 p -135.16 81.26 45.0 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.182 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -66.68 -33.4 35.43 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.708 1.605 . . . . 0.0 111.186 -169.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.46 -53.61 9.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.186 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -61.8 -43.39 98.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.235 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.66 95.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.233 178.49 . . . . . . . . 1 1 . 1 . 009 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 116.178 -0.464 . . . . 0.0 112.157 179.164 . . . . . . . . 1 1 . 1 . 009 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 . 009 nuclear orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.5 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 . 009 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.6 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 . 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 . . . . . . . . . . . . . 5.6 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 40.1 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.477 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 . . . . . . . . . . . . . 51.6 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 . 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 . . . . . . . . . . . . . 25.1 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 . . . . . 0.484 HD22 ' HA ' ' A' ' 101' ' ' ASN . 95.6 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 . 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 . . . . . . . . . . . . . 94.5 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 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.6 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 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.5 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 . . . . . . . . . . . . . 41.8 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 . 010 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 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 88.4 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 . 010 nuclear orig 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 . 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 . . . . . . . . . . . . . 66.4 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 15.1 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 . . . . . . . . . . . . . 99.4 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 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.1 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 . 010 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 . 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 . . . . . . . . . . . . . 77.0 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 . . . . . 0.504 HD13 HG21 ' A' ' 27' ' ' ILE . 46.3 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 . . . . . . . . . . . . . 85.0 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 . . . . . . . . . . . . . 27.6 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 . 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 . . . . . 0.42 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 . 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 . . . . . 0.42 ' 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 52.3 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 . . . . . . . . . . . . . 71.2 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 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 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 . . . . . . . . . . . . . 45.6 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 . 010 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 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 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 . . . . . . . . . . . . . 90.8 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 . 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 . . . . . . . . . . . . . 33.0 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 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.6 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.431 HG22 HD23 ' A' ' 118' ' ' LEU . 69.9 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 . . . . . . . . . . . . . 73.8 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 . 010 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 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 83.6 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 . . . . . . . . . . . . . 84.6 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 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.6 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 . . . . . 0.477 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.41 -46.28 81.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.19 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . 0.484 ' HA ' HD22 ' A' ' 7' ' ' LEU . 13.7 t-20 -59.39 -44.88 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.215 175.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.3 tpp -57.88 -32.77 68.01 Favored 'General case' 0 C--N 1.275 -2.645 0 C-N-CA 125.197 1.399 . . . . 0.0 111.15 -174.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.6 m -108.7 1.47 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -72.07 -44.22 63.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -100.31 -56.48 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.214 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 99.4 mmm -71.59 133.47 45.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.195 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -93.77 -151.73 28.44 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -50.41 -36.49 33.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.766 0.317 . . . . 0.0 111.209 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 88.0 m -56.22 -39.16 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.151 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -84.42 -30.87 26.39 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.7 t -62.98 -31.78 53.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.834 0.349 . . . . 0.0 111.178 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.31 -45.26 80.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.215 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.07 33.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.184 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -62.92 -29.92 71.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.207 177.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 82.4 m -62.24 -27.04 68.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.197 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.72 -19.87 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.161 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.0 m -111.3 0.53 16.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.212 -173.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.585 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 42.2 mt -66.82 -40.84 33.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 61.9 Cg_exo -58.61 -43.28 46.34 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 121.655 1.57 . . . . 0.0 111.212 -178.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.1 mmt -67.24 -42.7 83.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.171 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.42 -46.93 88.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.174 179.624 . . . . . . . . 1 1 . 1 . 010 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 119.671 -0.812 . . . . 0.0 111.873 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.1 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 . . . . . . . . . . . . . 82.2 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 . . . . . . . . . . . . . 19.6 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 . . . . . . . . . . . . . 77.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -65.34 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.32 -33.98 76.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.225 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.72 -14.25 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.207 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -95.04 3.01 55.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.162 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 56.8 p -75.04 160.44 30.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -67.87 -29.53 68.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.225 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 19.7 t-105 -61.95 -45.9 91.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 176.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -64.62 -42.6 95.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.213 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -56.89 -44.01 81.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.196 173.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -69.72 -50.08 47.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.229 -174.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 27.8 m -142.72 79.25 15.17 Favored Pre-proline 0 C--N 1.293 -1.887 0 C-N-CA 123.346 0.658 . . . . 0.0 111.251 -176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.96 -19.22 46.26 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 121.736 1.624 . . . . 0.0 111.235 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.05 -28.06 69.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.231 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -99.84 -39.45 8.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.209 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.48 -35.06 79.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -169.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.157 178.147 . . . . . . . . 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 . . . . . . . . . . . . . 88.2 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 . 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 . . . . . . . . . . . . . 17.1 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 . . . . . . . . . . . . . 35.6 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 . . . . . . . . . . . . . 89.5 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 . 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 . . . . . . . . . . . . . 96.0 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 . . . . . 0.404 ' HD3' ' HA ' ' 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 . . . . . . . . 2 2 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . . . . . . . . . 26.2 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 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.487 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 . . . . . . . . . . . . . 55.1 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 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 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 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.1 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 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.7 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 . 001 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 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 93.9 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 . . . . . . . . . . . . . 88.4 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 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 44.4 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 . . . . . . . . . . . . . 78.7 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 . . . . . . . . . . . . . 90.4 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 . 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 . . . . . . . . . . . . . 87.3 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 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 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 88.5 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 . 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 . . . . . . . . . . . . . 60.5 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 . . . . . . . . . . . . . 86.4 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 . . . . . . . . . . . . . 63.4 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 . . . . . . . . . . . . . 89.5 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 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 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 . 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 . . . . . . . . . . . . . 41.0 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.4 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 . 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 . 001 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 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 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 . . . . . 0.419 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 . 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 . . . . . 0.419 ' 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 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.8 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 . . . . . . . . . . . . . 43.1 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 . 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 . . . . . . . . . . . . . 62.5 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 . 001 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 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 89.5 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 . . . . . . . . . . . . . 97.0 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 . . . . . . . . . . . . . 64.9 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 . . . . . 0.4 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 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.9 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 . 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 . . . . . . . . . . . . . 87.6 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 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 001 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 . 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 . . . . . . . . . . . . . 79.6 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 . . . . . . . . . . . . . 93.0 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 . . . . . . . . . . . . . 32.3 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 . 001 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 . 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 . . . . . . . . . . . . . 99.7 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 . . . . . . . . . . . . . 97.6 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 . . . . . . . . . . . . . 58.5 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 . . . . . 0.533 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.7 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 59.0 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 . . . . . . . . . . . . . 96.2 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 . 001 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 . 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 . . . . . . . . . . . . . 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 . 001 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 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.5 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 . 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 . . . . . 0.487 HG21 HG12 ' A' ' 3' ' ' ILE . 96.7 mt -55.66 -39.67 56.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.764 0.316 . . . . 0.0 111.186 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -66.75 -47.0 73.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.141 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.0 mmm -61.72 -25.92 67.73 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.217 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.476 ' O ' HG12 ' A' ' 103' ' ' VAL . 44.4 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.561 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.5 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.788 0.328 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 71.4 Cg_exo -56.05 -41.94 71.79 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.678 1.585 . . . . 0.0 111.25 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.478 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.1 mmt -65.77 -42.96 90.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.195 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.32 -51.14 70.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.15 176.83 . . . . . . . . 1 1 . 1 . 001 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 119.671 -0.812 . . . . 0.0 111.873 -174.575 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 001 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 . 001 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 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.478 ' 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 . 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 . . . . . . . . . . . . . 53.3 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 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -65.65 -32.8 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.223 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.28 -34.3 74.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.193 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.16 -15.97 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.238 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.7 mttt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.18 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo . . . . . 0 N--CA 1.458 -0.579 0 N-CA-C 111.212 -0.341 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -69.54 -50.61 43.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.165 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.11 -36.59 84.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.791 0.329 . . . . 0.0 111.203 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.64 -41.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.216 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.157 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 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 . 001 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.4 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 . . . . . . . . . . . . . 96.4 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 . 001 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 17.0 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 . 001 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.4 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 . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 70.9 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 . 001 nuclear build core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.7 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 . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 41.7 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 . . . . . . . . . . . . . 26.2 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 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.507 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 . 002 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 . 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 . . . . . . . . . . . . . 11.4 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 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.415 HD21 ' HA ' ' A' ' 101' ' ' ASN . 84.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.5 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 . . . . . . . . . . . . . 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 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 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 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.0 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 . . . . . . . . . . . . . 64.0 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . 0.505 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 . 002 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 . 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 . . . . . 0.421 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 . 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 . . . . . 0.421 ' 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 . 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 . . . . . . . . . . . . . 48.1 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 93.2 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 99.4 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 . 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 . . . . . . . . . . . . . 58.8 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 . 002 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 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.1 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 . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 002 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . . . -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 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 . . . . . 0.507 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -55.51 -40.45 58.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.769 0.319 . . . . 0.0 111.192 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.415 ' HA ' HD21 ' A' ' 7' ' ' LEU . 52.2 t-20 -65.66 -41.11 92.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.239 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 97.0 mmm -63.79 -33.57 75.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 63.7 t . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.235 178.14 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.601 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 51.1 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.768 0.318 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 49.3 Cg_exo -62.48 -44.32 18.59 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.644 1.563 . . . . 0.0 111.233 -178.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 34.9 mmt -65.96 -40.93 91.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.206 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -59.15 -49.74 76.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.232 176.309 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.717 . . . . . . . . 1 1 . 1 . 002 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 . 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 . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -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 . . . . . . . . . . . . . 53.1 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 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.92 -41.36 64.35 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 . . . . . . . . . . . . . 83.1 mt -75.38 -37.29 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.15 65.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.199 -176.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.0 mttt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 179.791 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 111.199 -0.347 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -76.1 -48.11 21.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.193 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -74.4 -35.76 63.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.203 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.3 88.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.204 -179.772 . . . . . . . . 1 1 . 1 . 002 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 116.187 -0.461 . . . . 0.0 112.157 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 65.7 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 . . . . . . . . . . . . . 84.0 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 . . . . . . . . . . . . . 83.2 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 . 002 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 . 002 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.2 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 . . . . . . . . . . . . . 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 . 002 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 43.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 96.6 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 . 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.2 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 . 003 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 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 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 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.2 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 . . . . . . . . . . . . . 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 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 79.1 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 . . . . . . . . . . . . . 90.6 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 . 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 . . . . . . . . . . . . . 87.2 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.4 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 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 90.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 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 . 003 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 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.0 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 . . . . . . . . . . . . . 99.3 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 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.9 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 . 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 . . . . . . . . . . . . . 29.1 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 . 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 . . . . . . . . . . . . . 48.1 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 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.9 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 . 45.8 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 . 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 . . . . . . . . . . . . . 27.4 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.1 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 . . . . . . . . . . . . . 40.7 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 . . . . . . . . . . . . . 2.9 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 . . . . . . . . . . . . . 90.1 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 . 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 . . . . . . . . . . . . . 68.8 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 64.4 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 . . . . . 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 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.4 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 . . . . . . . . . . . . . 45.6 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 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.9 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 . . . . . . . . . . . . . 98.5 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . 0.538 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.0 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 . . . . . . . . . . . . . 72.2 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 . 003 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 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 93.0 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 . 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 . . . . . . . . . . . . . 96.3 mt -59.52 -30.04 43.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.815 0.34 . . . . 0.0 111.199 177.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -77.0 -39.27 51.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 177.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 93.1 mmm -60.99 -44.7 97.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.218 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.4 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.233 -178.616 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.591 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 49.2 mt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.781 0.324 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.591 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 75.4 Cg_exo -56.21 -43.4 56.49 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 121.708 1.605 . . . . 0.0 111.171 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.7 mmt -66.61 -38.32 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.184 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.04 -47.55 74.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.216 178.422 . . . . . . . . 1 1 . 1 . 003 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 119.671 -0.812 . . . . 0.0 111.873 179.722 . . . . . . . . 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 . . . . . . . . . . . . . 81.7 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 . 003 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 003 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 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -64.29 -34.44 78.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.206 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -73.81 -34.74 64.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.238 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -16.48 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.164 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.6 mttt . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.238 178.828 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo . . . . . 0 N--CA 1.458 -0.592 0 N-CA-C 111.167 -0.359 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -70.78 -56.67 5.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.2 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -59.89 -45.15 93.44 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 125.05 1.34 . . . . 0.0 111.165 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -60.91 -43.39 98.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.219 177.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.157 176.966 . . . . . . . . 1 1 . 1 . 003 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 . 003 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.7 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 . . . . . . . . . . . . . 90.2 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 . 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 . . . . . . . . . . . . . 19.8 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 . . . . . . . . . . . . . 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 . 003 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.7 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 . 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 . . . . . . . . . . . . . 68.9 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 . . . . . . . . . . . . . 91.0 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 . . . . . . . . . . . . . 95.4 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 30.8 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 . 003 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.44 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 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.1 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 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 17.9 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 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 84.6 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 . 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 . . . . . . . . . . . . . 87.3 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 . 004 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 . 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 . . . . . . . . . . . . . 42.0 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 . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 69.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 65.5 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 . . . . . . . . . . . . . 85.6 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 . 004 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 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 87.8 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 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 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 . . . . . . . . . . . . . 44.6 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . 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 . 004 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 31.2 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 . 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 . . . . . . . . . . . . . 50.8 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 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.7 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 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.3 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.6 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 . 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 . . . . . . . . . . . . . 87.5 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 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.4 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 . . . . . . . . . . . . . 69.0 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 95.2 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 . 004 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 . 004 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 . 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 . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 58.7 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 . . . . . 0.549 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.6 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 . . . . . . . . . . . . . 74.0 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 . . . . . . . . . . . . . 57.4 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 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 7.4 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.5 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 . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -37.03 59.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.407 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 55.1 t-20 -76.6 -32.37 58.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.168 179.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 tpp -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.164 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.214 179.519 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.574 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 47.8 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.775 0.321 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 53.2 Cg_exo -57.37 -42.54 60.83 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.714 1.609 . . . . 0.0 111.207 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -64.91 -43.2 93.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.192 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.68 -47.93 84.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.206 177.061 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -176.649 . . . . . . . . 1 1 . 1 . 004 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 . 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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -61.61 -35.96 79.36 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 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.36 -33.71 67.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 -176.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.64 62.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.19 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 178.456 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo . . . . . 0 N--CA 1.457 -0.629 0 N-CA-C 111.222 -0.338 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.75 -49.48 38.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.238 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -69.66 -37.73 76.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.173 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.75 -37.46 82.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.197 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.9 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 . . . . 0.0 112.157 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 96.3 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 . 004 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.3 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 . 004 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 . 004 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.3 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 . . . . . . . . . . . . . 30.8 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.7 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 . . . . . 0.438 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 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.0 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 9.9 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 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.2 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 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.9 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 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.6 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 . 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 . . . . . . . . . . . . . 78.9 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 . . . . . . . . . . . . . 87.3 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 . 005 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 80.9 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 . . . . . . . . . . . . . 58.6 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 . 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 86.5 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.5 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 87.7 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 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.5 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 . . . . . . . . . . . . . 41.4 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 . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 84.5 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 43.7 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 . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 62.5 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 . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.8 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 . 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 . . . . . . . . . . . . . 87.6 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 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.8 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.0 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 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 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 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 . . . . . 0.466 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 . 005 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.5 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 . 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 . . . . . . . . . . . . . 58.8 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 . 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 . . . . . . . . . . . . . 7.3 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 . 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 . . . . . . . . . . . . . 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 . 005 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 . 005 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 . 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 . . . . . 0.401 ' O ' HG22 ' A' ' 103' ' ' VAL . . . -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 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.438 HG21 HG12 ' A' ' 3' ' ' ILE . 96.2 mt -58.08 -29.24 36.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.788 0.327 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -78.99 -35.59 42.66 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 125.358 1.463 . . . . 0.0 111.212 178.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.2 mmm -70.98 -15.14 62.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.216 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 99' ' ' ALA . 25.6 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 -178.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.551 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 71.4 mt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.798 0.333 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 98.2 Cg_exo -50.33 -46.06 30.89 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.739 1.626 . . . . 0.0 111.185 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.2 mmt -66.05 -41.88 90.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.78 -47.89 83.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.23 -179.287 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.758 . . . . . . . . 1 1 . 1 . 005 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 . 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 . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 94.7 m-20 -65.97 -34.95 79.29 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 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.43 -31.39 67.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 177.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.0 -14.69 63.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.205 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.264 178.935 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo . . . . . 0 N--CA 1.458 -0.611 0 N-CA-C 111.245 -0.329 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -66.17 -53.48 36.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.158 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.31 -64.49 0.85 Allowed 'General case' 0 C--N 1.319 -0.757 0 O-C-N 122.01 -0.431 . . . . 0.0 111.19 175.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -44.37 -44.0 7.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.243 178.778 . . . . . . . . 1 1 . 1 . 005 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 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 005 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 . 005 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 . 005 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 19.1 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 . 005 nuclear build core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.2 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 . . . . . . . . . . . . . 82.1 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 . . . . . . . . . . . . . 53.8 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 . . . . . . . . . . . . . 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 . 005 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.1 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 . . . . . . . . . . . . . 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 . 005 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 . 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 . . . . . . . . . . . . . 26.3 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 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.5 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 . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 54.3 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 . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 91.5 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 . . . . . . . . . . . . . 67.0 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 . . . . . . . . . . . . . 45.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 87.2 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 . 006 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 . 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 . . . . . . . . . . . . . 82.8 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 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 14.9 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 . . . . . . . . . . . . . 99.3 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 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 29.0 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 . 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 . . . . . . . . . . . . . 97.5 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 . 006 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 . 006 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 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 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 . 006 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 . 006 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 . 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 . . . . . 0.417 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 . . . . . 0.417 ' 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 . 006 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 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.5 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 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 51.9 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 97.7 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 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.7 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 . . . . . . . . . . . . . 71.2 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 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.3 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 76.1 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 . 006 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 . 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 . . . . . . . . . . . . . 86.0 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.574 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 . . . . . . . . . . . . . 74.4 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 . 006 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 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 95.1 mt -61.21 -36.5 73.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.803 0.335 . . . . 0.0 111.186 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 23.0 t-20 -64.09 -45.7 87.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.99 -43.15 73.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.194 179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.239 -174.309 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.608 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 76.5 mt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.784 0.326 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.608 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.1 Cg_exo -60.89 -48.81 9.68 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.682 1.588 . . . . 0.0 111.214 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.411 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.4 mmt -61.65 -45.76 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.02 -46.82 87.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.196 -177.328 . . . . . . . . 1 1 . 1 . 006 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 119.671 -0.812 . . . . 0.0 111.873 -179.491 . . . . . . . . 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 . . . . . . . . . . . . . 93.3 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 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.411 ' 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 . . . . . . . . . . . . . 35.9 t30 -54.27 -44.26 71.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.31 -37.41 68.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.68 -20.19 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.244 -176.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.185 176.838 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo . . . . . 0 N--CA 1.458 -0.583 0 N-CA-C 111.206 -0.344 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -74.15 -45.08 51.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -71.47 -35.86 70.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.67 -35.53 72.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.259 178.61 . . . . . . . . 1 1 . 1 . 006 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 116.175 -0.466 . . . . 0.0 112.157 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 75.2 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 . 006 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 25.2 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 . . . . . . . . . . . . . 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 . 006 nuclear build core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 34.2 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 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 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.5 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 16.3 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 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.0 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 . . . . . . . . 1 1 . 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 . . . . . . . . . . . . . 94.2 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 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.2 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 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.7 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 . 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 . . . . . . . . . . . . . 45.7 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 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.8 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 . . . . . . . . . . . . . 87.2 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 . 007 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 . 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 . . . . . . . . . . . . . 41.5 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 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 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 . . . . . . . . . . . . . 70.8 mm-40 -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 . . . . . . . . . . . . . 30.3 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 . . . . . . . . . . . . . 85.2 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 . 007 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 81.2 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 . . . . . . . . . . . . . 63.7 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 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 12.6 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 . 007 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 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 77.2 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 . . . . . 0.504 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 . 007 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 40.4 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 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 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 . . . . . . . . . . . . . 63.0 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 . 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 72.0 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 . 007 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 . 007 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 69.6 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 91.9 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 77.1 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 . 007 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 007 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 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 97.1 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 . 007 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -57.07 -34.97 46.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -76.1 -39.27 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.194 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -62.09 -27.36 68.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.199 173.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.462 ' O ' HG12 ' A' ' 103' ' ' VAL . 38.2 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.213 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 69.4 mt . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.805 0.336 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 83.7 Cg_exo -52.54 -47.93 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.705 1.603 . . . . 0.0 111.242 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.09 -31.36 30.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.2 -173.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.9 mt -55.96 -52.12 65.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.202 174.533 . . . . . . . . 1 1 . 1 . 007 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 119.671 -0.812 . . . . 0.0 111.873 -177.718 . . . . . . . . 1 1 . 1 . 007 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 . 007 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 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 21.1 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 . . . . . . . . . . . . . 50.3 mt-10 -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 . . . . . . . . . . . . . 54.9 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 . . . . . . . . . . . . . 94.7 m-20 -58.07 -42.1 84.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.11 -36.3 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.184 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.93 -24.6 66.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.203 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 179.828 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo . . . . . 0 N--CA 1.458 -0.6 0 N-CA-C 111.178 -0.355 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -50.81 25.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.231 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.4 ttm105 -68.16 -33.44 74.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.225 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.95 -35.65 57.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.157 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 74.7 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 . . . . . . . . . . . . . 94.4 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 . . . . . . . . . . . . . 4.5 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 . . . . . . . . . . . . . 81.9 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 . 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 . . . . . . . . . . . . . 59.8 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 . . . . . . . . . . . . . 90.6 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 . 007 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 . 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 . . . . . . . . . . . . . 96.6 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 . 007 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 . 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 . . . . . . . . . . . . . 51.7 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 . 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 . . . . . . . . . . . . . 11.6 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 . . . . . . . . . . . . . 82.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.8 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 . 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 . . . . . . . . . . . . . 45.7 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 . 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 . . . . . . . . . . . . . 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 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.9 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 . . . . . . . . . . . . . 70.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 89.2 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 . 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 . . . . . . . . . . . . . 66.5 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 . . . . . . . . . . . . . 86.6 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 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.5 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 . . . . . . . . . . . . . 15.0 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 . . . . . . . . . . . . . 99.4 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 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.6 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 77.0 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 . 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 . 008 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 . 008 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 32.4 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 . . . . . . . . . . . . . 51.9 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 . 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 . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.5 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.6 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 76.8 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 . 008 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 . 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 . . . . . . . . . . . . . 94.2 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 . . . . . . . . . . . . . 95.2 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 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.3 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 . 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 . . . . . . . . . . . . . 58.9 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 . 008 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 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.544 HG21 ' HB3' ' A' ' 118' ' ' LEU . 68.8 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 . 008 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.1 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 . 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 . . . . . . . . . . . . . 57.7 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 . . . . . . . . . . . . . 97.1 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.0 mt -60.21 -30.92 46.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.188 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -75.15 -34.78 61.65 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.743 0.417 . . . . 0.0 111.19 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.6 mmm -68.68 -21.21 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.222 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -177.34 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.6 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 50.5 Cg_exo -56.0 -50.13 13.31 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 121.739 1.626 . . . . 0.0 111.221 174.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.9 mmt -61.49 -43.12 99.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.58 -47.22 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.191 179.517 . . . . . . . . 1 1 . 1 . 008 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 119.671 -0.812 . . . . 0.0 111.873 -178.971 . . . . . . . . 1 1 . 1 . 008 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 . 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 . . . . . . . . . . . . . 81.6 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 . . . . . . . . . . . . . 19.9 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 . 008 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 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -48.95 -46.19 42.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.19 -38.58 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.167 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.84 -23.27 67.29 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 123.944 0.897 . . . . 0.0 111.205 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.198 -178.632 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo . . . . . 0 N--CA 1.458 -0.592 0 N-CA-C 111.189 -0.35 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -74.68 -48.78 24.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.232 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -74.18 -37.2 64.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 176.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.36 -41.47 98.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.234 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.157 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 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 . 008 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.1 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 . . . . . . . . . . . . . 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 . 008 nuclear build core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.7 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 26.3 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 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.453 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 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 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 . 009 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 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.2 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 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 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 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 47.1 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 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 . . . . . . . . . . . . . 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 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . 0.505 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 . 009 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 . 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 . . . . . 0.419 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 . . . . . 0.419 ' 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 . 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 . . . . . . . . . . . . . 42.9 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 71.3 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 . . . . . . . . . . . . . 38.0 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 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 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 . . . . . . . . . . . . . 97.7 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 74.4 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 . 009 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 . 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 . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.5 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 . 009 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 . 009 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 . 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 . . . . . 0.474 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.4 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 . 009 nuclear build core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.9 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 . . . . . . . . . . . . . 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 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 95.6 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.7 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 . 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 . . . . . 0.453 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.53 -34.87 48.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -74.74 -33.53 62.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.137 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 90.9 mmm -72.32 -14.39 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.191 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.227 -178.292 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.609 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 60.8 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.774 0.321 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.5 Cg_exo -59.62 -41.5 55.64 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 121.711 1.607 . . . . 0.0 111.198 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -71.98 -42.39 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.202 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.19 -48.71 80.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.16 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.873 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 93.4 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 . 009 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 . 009 nuclear build core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 55.6 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 . . . . . . . . . . . . . 88.3 m-20 -56.49 -39.5 73.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.215 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.9 mt -73.89 -41.52 62.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.204 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.59 -32.54 71.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.222 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.224 -177.162 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 N--CA 1.458 -0.585 0 N-CA-C 111.186 -0.352 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.46 -53.61 9.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.186 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -61.8 -43.39 98.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.235 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.66 95.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.233 178.49 . . . . . . . . 1 1 . 1 . 009 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 116.178 -0.464 . . . . 0.0 112.157 179.164 . . . . . . . . 1 1 . 1 . 009 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 . 009 nuclear build core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.5 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 . 009 nuclear build core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.6 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 . 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 . . . . . . . . . . . . . 5.6 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 40.1 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.485 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 . . . . . . . . . . . . . 51.6 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 . 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 . . . . . 0.431 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 25.1 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 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 101' ' ' ASN . 95.6 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 . 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 . . . . . . . . . . . . . 94.5 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 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.6 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 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.5 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 . . . . . . . . . . . . . 41.8 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 . 010 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 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 88.4 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 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.4 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 15.1 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 . . . . . . . . . . . . . 99.4 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 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.1 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 . 010 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 . 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 . . . . . . . . . . . . . 77.0 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 . 46.3 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 . . . . . . . . . . . . . 85.0 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 . . . . . . . . . . . . . 27.6 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 . 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 52.3 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 . . . . . . . . . . . . . 71.2 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 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 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 . . . . . . . . . . . . . 45.6 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 . 010 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 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 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 . . . . . . . . . . . . . 90.8 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 . 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 . . . . . . . . . . . . . 33.0 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 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.6 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.442 HG21 ' HB3' ' A' ' 118' ' ' LEU . 69.9 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 . . . . . . . . . . . . . 73.8 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 . 010 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 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 83.6 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 . . . . . . . . . . . . . 84.6 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 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.6 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 . . . . . 0.431 ' 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 . 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 . . . . . 0.485 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.41 -46.28 81.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.19 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASN . . . . . 0.482 ' HA ' HD21 ' A' ' 7' ' ' LEU . 13.7 t-20 -59.39 -44.88 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.215 175.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.3 tpp -57.88 -32.77 68.01 Favored 'General case' 0 C--N 1.275 -2.645 0 C-N-CA 125.197 1.399 . . . . 0.0 111.15 -174.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.6 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.542 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.585 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 42.2 mt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.8 0.333 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 61.9 Cg_exo -58.61 -43.28 46.34 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 121.655 1.57 . . . . 0.0 111.212 -178.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.1 mmt -67.24 -42.7 83.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.171 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.42 -46.93 88.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.174 179.624 . . . . . . . . 1 1 . 1 . 010 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 119.671 -0.812 . . . . 0.0 111.873 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.1 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 . . . . . . . . . . . . . 82.2 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 . . . . . . . . . . . . . 19.6 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 . . . . . . . . . . . . . 77.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -65.34 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.32 -33.98 76.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.225 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.72 -14.25 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.207 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.162 -179.408 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 N--CA 1.458 -0.591 0 N-CA-C 111.235 -0.333 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.05 -28.06 69.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.231 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -99.84 -39.45 8.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.209 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.48 -35.06 79.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -169.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.157 178.147 . . . . . . . . 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 . . . . . . . . . . . . . 88.2 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 . 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 . . . . . . . . . . . . . 17.1 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 . . . . . . . . . . . . . 35.6 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 . . . . . . . . . . . . . 89.5 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 . 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 . . . . . . . . . . . . . 96.0 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 . . . . . . . . . . . . . 31.5 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . . . . . . . . . 26.2 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 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.487 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 . . . . . . . . . . . . . 55.1 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 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 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 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.1 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 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.7 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 . 001 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 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 93.9 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 . . . . . . . . . . . . . 88.4 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 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 44.4 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 . . . . . . . . . . . . . 78.7 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 . . . . . . . . . . . . . 90.4 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 . 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 . . . . . . . . . . . . . 87.3 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 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 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 88.5 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 . 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 . . . . . . . . . . . . . 60.5 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 . . . . . . . . . . . . . 86.4 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 . . . . . . . . . . . . . 63.4 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 . . . . . . . . . . . . . 89.5 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 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 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 . 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 . . . . . . . . . . . . . 41.0 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.4 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 . 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 . 001 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 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 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 . . . . . 0.419 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 . 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 . . . . . 0.419 ' 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 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.8 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 . . . . . . . . . . . . . 43.1 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 . 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 . . . . . . . . . . . . . 62.5 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 . 001 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 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 89.5 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 . . . . . . . . . . . . . 97.0 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 . . . . . . . . . . . . . 64.9 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 . . . . . 0.4 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 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.9 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 . 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 . . . . . . . . . . . . . 87.6 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 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 001 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 . 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 . . . . . . . . . . . . . 79.6 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 . . . . . . . . . . . . . 93.0 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 . . . . . . . . . . . . . 32.3 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 . 001 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 . 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 . . . . . . . . . . . . . 99.7 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 . . . . . . . . . . . . . 97.6 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 . . . . . . . . . . . . . 58.5 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 . . . . . 0.533 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.7 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 59.0 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 . . . . . . . . . . . . . 96.2 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 . 001 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 . 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 . . . . . . . . . . . . . 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 . 001 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 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.5 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 . 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 . . . . . 0.487 HG21 HG12 ' A' ' 3' ' ' ILE . 96.7 mt -55.66 -39.67 56.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.764 0.316 . . . . 0.0 111.186 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -66.75 -47.0 73.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.141 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.0 mmm -61.72 -25.92 67.73 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.217 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.476 ' O ' HG12 ' A' ' 103' ' ' VAL . 44.4 t -95.04 -12.35 8.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -73.78 103.73 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.198 -172.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 55.25 34.85 23.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.184 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 59.2 tpp -87.46 147.08 25.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.04 162.64 48.68 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.31 -35.08 79.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 111.185 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.9 m -70.65 -40.47 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.172 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.97 -45.37 95.27 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 174.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.0 t -65.22 -42.77 94.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 111.22 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.06 81.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.175 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.84 -34.71 71.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.206 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -66.79 -36.26 81.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.196 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.407 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 83.6 m -57.59 -33.7 68.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.183 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.39 -19.88 64.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.168 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 71.2 m -100.65 -0.73 36.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.197 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.561 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.5 mt -64.89 -40.97 51.94 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.197 -175.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 71.4 Cg_exo -56.05 -41.94 71.79 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.678 1.585 . . . . 0.0 111.25 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.478 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.1 mmt -65.77 -42.96 90.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.195 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.32 -51.14 70.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.15 176.83 . . . . . . . . 1 1 . 1 . 001 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 119.671 -0.812 . . . . 0.0 111.873 -174.575 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 001 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 . 001 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 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.478 ' 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 . 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 . . . . . . . . . . . . . 53.3 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 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -65.65 -32.8 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.223 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.28 -34.3 74.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.193 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.16 -15.97 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.238 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -83.41 -8.75 59.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.1 p -74.25 161.08 30.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.216 -171.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -65.1 -34.75 79.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.212 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -54.4 -42.32 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.196 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -66.64 -42.35 86.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.195 -178.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -61.11 -39.89 91.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.173 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -73.87 -48.61 29.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.213 -177.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 44.7 p -134.35 81.94 48.08 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.219 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -58.94 -34.81 99.28 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 121.682 1.588 . . . . 0.0 111.212 -174.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -69.54 -50.61 43.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.165 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.11 -36.59 84.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.791 0.329 . . . . 0.0 111.203 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.64 -41.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.216 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.157 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 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 . 001 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.4 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 . . . . . . . . . . . . . 96.4 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 . 001 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 17.0 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 . 001 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.4 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 . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 70.9 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 . 001 nuclear build full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.7 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 . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 41.7 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 . . . . . . . . . . . . . 26.2 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 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.507 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 . 002 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 . 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 . . . . . . . . . . . . . 11.4 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 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.415 HD21 ' HA ' ' A' ' 101' ' ' ASN . 84.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.5 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 . . . . . . . . . . . . . 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 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 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 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.0 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 . . . . . . . . . . . . . 64.0 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . 0.505 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 . 002 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 . 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 . . . . . 0.421 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 . 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 . . . . . 0.421 ' 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 . 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 . . . . . . . . . . . . . 48.1 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 93.2 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 99.4 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 . 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 . . . . . . . . . . . . . 58.8 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 . 002 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 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.1 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 . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 002 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . . . -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 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 . . . . . 0.507 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -55.51 -40.45 58.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.769 0.319 . . . . 0.0 111.192 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.415 ' HA ' HD21 ' A' ' 7' ' ' LEU . 52.2 t-20 -65.66 -41.11 92.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.239 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 97.0 mmm -63.79 -33.57 75.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 63.7 t -86.58 -17.92 8.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.235 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -71.9 75.05 0.89 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 49.35 56.36 7.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 172.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 63.3 tpp -95.71 -14.28 23.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.71 164.57 24.26 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.29 -33.4 75.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.799 0.333 . . . . 0.0 111.222 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 96.4 m -64.63 -41.88 95.87 Favored 'General case' 0 N--CA 1.457 -0.083 0 O-C-N 122.137 -0.352 . . . . 0.0 111.221 177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.98 -41.72 93.07 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.48 -43.95 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.799 0.333 . . . . 0.0 111.176 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.13 83.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -68.47 -39.41 81.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.412 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 93.9 m -58.99 -37.38 76.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.193 178.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -66.05 -24.66 66.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.181 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p -102.56 3.91 37.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.198 -171.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.601 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 51.1 mt -67.84 -39.92 20.87 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.221 -173.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 49.3 Cg_exo -62.48 -44.32 18.59 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.644 1.563 . . . . 0.0 111.233 -178.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 34.9 mmt -65.96 -40.93 91.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.206 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -59.15 -49.74 76.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.232 176.309 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.717 . . . . . . . . 1 1 . 1 . 002 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 . 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 . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -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 . . . . . . . . . . . . . 53.1 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 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.92 -41.36 64.35 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 . . . . . . . . . . . . . 83.1 mt -75.38 -37.29 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.15 65.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.199 -176.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -98.28 11.46 37.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 58.0 m -94.63 161.93 14.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.229 178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -60.34 -31.7 70.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.238 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -56.25 -52.96 62.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.192 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -62.71 -35.61 80.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.202 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -66.88 -26.86 67.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.193 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -84.45 -45.35 12.77 Favored 'General case' 0 C--N 1.395 2.547 0 O-C-N 119.583 -1.948 . . . . 0.0 111.17 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 43.7 p -131.65 73.14 79.57 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.217 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.21 -23.29 45.53 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 121.721 1.614 . . . . 0.0 111.199 -176.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -76.1 -48.11 21.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.193 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -74.4 -35.76 63.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.203 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.3 88.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.204 -179.772 . . . . . . . . 1 1 . 1 . 002 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 116.187 -0.461 . . . . 0.0 112.157 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 65.7 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 . . . . . . . . . . . . . 84.0 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 . . . . . . . . . . . . . 83.2 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 . 002 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 . 002 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.2 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 . . . . . . . . . . . . . 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 . 002 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 43.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 96.6 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 . 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.2 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 . 003 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 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 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 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.2 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 . . . . . . . . . . . . . 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 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 79.1 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 . . . . . . . . . . . . . 90.6 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 . 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 . . . . . . . . . . . . . 87.2 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.4 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 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 90.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 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 . 003 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 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.0 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 . . . . . . . . . . . . . 99.3 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 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.9 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 . 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 . . . . . . . . . . . . . 29.1 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 . 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 . . . . . . . . . . . . . 48.1 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 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.9 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 . 45.8 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 . 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 . . . . . . . . . . . . . 27.4 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.1 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 . . . . . . . . . . . . . 40.7 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 . . . . . . . . . . . . . 2.9 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 . . . . . . . . . . . . . 90.1 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 . 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 . . . . . . . . . . . . . 68.8 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 64.4 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 . . . . . 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 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.4 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 . . . . . . . . . . . . . 45.6 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 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 87.9 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 . . . . . . . . . . . . . 98.5 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . 0.538 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.0 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 . . . . . . . . . . . . . 72.2 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 . 003 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 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 93.0 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 . 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 . . . . . 0.443 ' O ' ' HB2' ' A' ' 104' ' ' PHE . 96.3 mt -59.52 -30.04 43.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.815 0.34 . . . . 0.0 111.199 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -77.0 -39.27 51.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 177.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 93.1 mmm -60.99 -44.7 97.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.218 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.4 m -77.24 -18.47 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.233 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' A' ' 100' ' ' ILE . 63.9 t80 -67.76 83.29 0.19 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.214 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 44.62 66.0 0.96 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.146 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 57.4 ttm -115.23 -30.03 6.42 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 123.44 0.696 . . . . 0.0 111.16 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.33 147.83 5.94 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.19 -0.764 . . . . 0.0 111.19 -177.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.43 -32.38 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 111.198 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 79.0 p -74.06 -27.25 60.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.193 175.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -70.17 -40.17 71.65 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.6 t -68.92 -40.45 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.781 0.325 . . . . 0.0 111.187 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.77 -46.0 92.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.196 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.12 89.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -62.41 -35.29 78.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.227 174.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.447 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 96.2 m -64.78 -36.75 85.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.166 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -72.28 -11.25 60.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.225 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.0 m -114.98 15.8 17.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.156 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.591 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 49.2 mt -74.44 -39.24 3.76 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.591 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 75.4 Cg_exo -56.21 -43.4 56.49 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 121.708 1.605 . . . . 0.0 111.171 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.7 mmt -66.61 -38.32 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.184 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.04 -47.55 74.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.216 178.422 . . . . . . . . 1 1 . 1 . 003 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 119.671 -0.812 . . . . 0.0 111.873 179.722 . . . . . . . . 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 . . . . . . . . . . . . . 81.7 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 . 003 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 003 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 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -64.29 -34.44 78.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.206 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -73.81 -34.74 64.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.238 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -16.48 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.164 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -94.32 10.62 33.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.238 178.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 83.3 p -69.09 164.84 21.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -76.74 -35.89 57.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.222 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -65.6 -32.7 74.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.173 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -50.22 -35.1 25.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.154 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.8 -41.2 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.196 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -71.74 -48.76 44.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.186 -175.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.7 p -132.08 74.55 76.45 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.166 -178.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.74 -30.28 84.66 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 121.715 1.61 . . . . 0.0 111.167 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -70.78 -56.67 5.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.2 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -59.89 -45.15 93.44 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 125.05 1.34 . . . . 0.0 111.165 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -60.91 -43.39 98.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.219 177.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.157 176.966 . . . . . . . . 1 1 . 1 . 003 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 . 003 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.7 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 . . . . . . . . . . . . . 90.2 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 . 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 . . . . . . . . . . . . . 19.8 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 . . . . . . . . . . . . . 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 . 003 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.7 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 . 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 . . . . . . . . . . . . . 68.9 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 . . . . . . . . . . . . . 91.0 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 . . . . . . . . . . . . . 95.4 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 30.8 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 . 003 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.44 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 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.1 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 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 17.9 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 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 84.6 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 . 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 . . . . . . . . . . . . . 87.3 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 . 004 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 . 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 . . . . . . . . . . . . . 42.0 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 . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 69.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 65.5 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 . . . . . . . . . . . . . 85.6 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 . 004 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 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 87.8 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 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 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 . . . . . . . . . . . . . 44.6 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . 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 . 004 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 31.2 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 . 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 . . . . . . . . . . . . . 50.8 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 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.7 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 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.3 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.6 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 . 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 . . . . . . . . . . . . . 87.5 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 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.4 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 . . . . . . . . . . . . . 69.0 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 95.2 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 . 004 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 . 004 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 . 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 . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 58.7 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 . . . . . 0.549 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.6 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 . . . . . . . . . . . . . 74.0 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 . . . . . . . . . . . . . 57.4 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 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 7.4 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.5 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 . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -37.03 59.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.407 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 55.1 t-20 -76.6 -32.37 58.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.168 179.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 tpp -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.164 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.6 m -96.86 8.53 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.214 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -77.97 79.41 4.44 Favored 'General case' 0 C--N 1.4 2.772 0 O-C-N 120.637 -1.289 . . . . 0.0 111.221 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 55.17 45.36 26.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.203 174.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 55.1 ttm -86.13 -27.16 24.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.184 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.06 162.36 14.41 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.01 -41.7 97.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 111.225 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.9 m -58.33 -44.5 88.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.205 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.85 -44.2 97.8 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.1 t -64.01 -36.09 75.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 111.178 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.33 -50.19 74.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.229 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.71 -36.98 83.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.179 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -63.88 -35.82 81.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.192 178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.505 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 76.9 m -61.04 -34.39 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.239 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.62 -9.3 58.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.224 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.0 m -111.9 8.91 20.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.574 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 47.8 mt -72.03 -40.82 8.15 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.198 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 53.2 Cg_exo -57.37 -42.54 60.83 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.714 1.609 . . . . 0.0 111.207 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -64.91 -43.2 93.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.192 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.68 -47.93 84.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.206 177.061 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -176.649 . . . . . . . . 1 1 . 1 . 004 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 . 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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -61.61 -35.96 79.36 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 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.36 -33.71 67.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 -176.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.64 62.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.19 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -84.24 -0.0 50.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 72.3 p -73.8 163.85 27.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.191 -176.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 80.8 ttt180 -70.61 -41.31 72.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.205 176.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -54.24 -40.99 68.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -61.26 -29.02 69.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -38.33 78.68 Favored 'General case' 1 C--N 1.433 4.201 0 O-C-N 119.236 -2.165 . . . . 0.0 111.203 -179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -85.53 -39.5 17.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.235 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.9 p -132.49 74.8 74.85 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.195 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.05 -28.94 48.98 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 121.673 1.582 . . . . 0.0 111.222 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.75 -49.48 38.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.238 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -69.66 -37.73 76.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.173 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.75 -37.46 82.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.197 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.9 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 . . . . 0.0 112.157 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 96.3 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 . 004 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.3 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 . 004 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 . 004 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.3 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 . . . . . . . . . . . . . 30.8 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.7 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 . . . . . 0.438 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 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.0 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 9.9 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 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.2 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 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.9 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 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.6 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 . 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 . . . . . . . . . . . . . 78.9 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 . . . . . . . . . . . . . 87.3 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 . 005 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 80.9 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 . . . . . . . . . . . . . 58.6 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 . 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 86.5 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.5 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 87.7 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 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.5 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 . . . . . . . . . . . . . 41.4 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 . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 84.5 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 43.7 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 . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 62.5 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 . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.8 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 . 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 . . . . . . . . . . . . . 87.6 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 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.8 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.0 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 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 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 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 . . . . . 0.466 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 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.5 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 . 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 . . . . . . . . . . . . . 58.8 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 . 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 . . . . . . . . . . . . . 7.3 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 . 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 . . . . . . . . . . . . . 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 . 005 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 . 005 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 . 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 . . . . . 0.401 ' O ' HG22 ' A' ' 103' ' ' VAL . . . -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 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.438 HG21 HG12 ' A' ' 3' ' ' ILE . 96.2 mt -58.08 -29.24 36.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.788 0.327 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -78.99 -35.59 42.66 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 125.358 1.463 . . . . 0.0 111.212 178.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.2 mmm -70.98 -15.14 62.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.216 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 99' ' ' ALA . 25.6 m -120.81 11.45 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -80.53 73.34 7.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.197 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 57.47 37.82 27.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.216 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 56.9 tpp -71.33 -28.65 64.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.122 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.5 155.01 23.18 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.0 -37.17 78.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 0.0 111.232 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 97.9 m -63.43 -42.35 98.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.196 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.89 -42.65 96.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 64.1 t -60.52 -43.09 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.753 0.311 . . . . 0.0 111.182 178.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.29 -35.06 68.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.215 -173.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.66 -37.64 88.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.217 169.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.32 -34.78 76.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.18 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.7 m -62.86 -33.85 76.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -176.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.7 -26.72 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.2 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.7 m -101.01 3.42 41.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.195 -168.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.551 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 71.4 mt -66.67 -40.57 32.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.216 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 98.2 Cg_exo -50.33 -46.06 30.89 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.739 1.626 . . . . 0.0 111.185 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.2 mmt -66.05 -41.88 90.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.78 -47.89 83.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.23 -179.287 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.758 . . . . . . . . 1 1 . 1 . 005 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 . 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 . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 94.7 m-20 -65.97 -34.95 79.29 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 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.43 -31.39 67.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 177.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.0 -14.69 63.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.205 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -92.44 7.32 43.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.264 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 76.9 p -73.23 160.84 31.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.228 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -70.42 -34.94 73.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.191 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -65.58 -35.15 80.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.188 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -55.83 -47.43 77.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.21 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -65.67 -35.43 80.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.206 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -67.87 -47.32 69.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.198 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 55.2 p -134.47 79.91 52.96 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.195 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -60.79 -38.57 69.54 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.704 1.602 . . . . 0.0 111.245 -173.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -66.17 -53.48 36.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.158 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.31 -64.49 0.85 Allowed 'General case' 0 C--N 1.319 -0.757 0 O-C-N 122.01 -0.431 . . . . 0.0 111.19 175.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -44.37 -44.0 7.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.243 178.778 . . . . . . . . 1 1 . 1 . 005 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 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 005 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 . 005 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 . 005 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 19.1 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 . 005 nuclear build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.2 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 . . . . . . . . . . . . . 82.1 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 . . . . . . . . . . . . . 53.8 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 . . . . . . . . . . . . . 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 . 005 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.1 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 . . . . . . . . . . . . . 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 . 005 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 . 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 . . . . . . . . . . . . . 26.3 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 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.5 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 . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 54.3 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 . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 91.5 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 . . . . . . . . . . . . . 67.0 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 . . . . . . . . . . . . . 45.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 87.2 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 . 006 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 . 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 . . . . . . . . . . . . . 82.8 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 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 14.9 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 . . . . . . . . . . . . . 99.3 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 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 29.0 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 . 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 . . . . . . . . . . . . . 97.5 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 . 006 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 . 006 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 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 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 . 006 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 . 006 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 . 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 . . . . . 0.417 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 . . . . . 0.417 ' 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 . 006 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 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.5 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 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 51.9 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 97.7 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 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.7 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 . . . . . . . . . . . . . 71.2 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 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.3 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 76.1 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 . 006 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 . 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 . . . . . . . . . . . . . 86.0 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.574 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 . . . . . . . . . . . . . 74.4 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 . 006 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 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 95.1 mt -61.21 -36.5 73.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.803 0.335 . . . . 0.0 111.186 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 23.0 t-20 -64.09 -45.7 87.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.99 -43.15 73.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.194 179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.4 m -100.83 20.64 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.239 -174.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -75.35 -40.98 57.63 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 117.809 -1.556 . . . . 0.0 111.182 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -80.81 -20.05 43.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 172.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 54.0 mtt 56.43 38.29 29.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.51 154.48 45.77 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -176.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.27 -44.62 87.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.82 0.343 . . . . 0.0 111.216 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 98.7 m -69.32 -40.19 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.22 -48.87 75.71 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.45 -43.2 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.849 0.357 . . . . 0.0 111.211 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.06 -46.86 88.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.203 -177.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.24 84.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.218 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.08 -34.61 78.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 -177.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.451 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 76.6 m -66.65 -26.34 67.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.148 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -85.81 -8.33 58.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.244 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 83.1 p -99.63 -0.62 39.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.608 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 76.5 mt -68.71 -39.17 13.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -170.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.608 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.1 Cg_exo -60.89 -48.81 9.68 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.682 1.588 . . . . 0.0 111.214 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.411 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.4 mmt -61.65 -45.76 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.02 -46.82 87.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.196 -177.328 . . . . . . . . 1 1 . 1 . 006 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 119.671 -0.812 . . . . 0.0 111.873 -179.491 . . . . . . . . 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 . . . . . . . . . . . . . 93.3 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 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.411 ' 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 . . . . . . . . . . . . . 35.9 t30 -54.27 -44.26 71.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.31 -37.41 68.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.68 -20.19 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.244 -176.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.05 6.13 45.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.185 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.2 m -90.18 166.2 13.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.176 176.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.84 -36.91 84.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.194 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -53.61 -38.7 64.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -73.27 -26.48 61.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.174 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -75.91 -30.68 58.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.201 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -84.88 -38.07 19.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.19 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 72.4 p -132.95 72.17 77.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -73.38 -33.22 7.26 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 121.266 1.31 . . . . 0.0 111.206 -169.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -74.15 -45.08 51.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -71.47 -35.86 70.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.67 -35.53 72.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.259 178.61 . . . . . . . . 1 1 . 1 . 006 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 116.175 -0.466 . . . . 0.0 112.157 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 75.2 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 . 006 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 25.2 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 . . . . . . . . . . . . . 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 . 006 nuclear build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 34.2 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 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 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.5 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 16.3 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 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.0 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 . . . . . . . . 1 1 . 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 . . . . . . . . . . . . . 94.2 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 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.2 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 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.7 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 . 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 . . . . . . . . . . . . . 45.7 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 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.8 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 . . . . . . . . . . . . . 87.2 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 . 007 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 . 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 . . . . . . . . . . . . . 41.5 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 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 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 . . . . . . . . . . . . . 70.8 mm-40 -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 . . . . . . . . . . . . . 30.3 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 . . . . . . . . . . . . . 85.2 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 . 007 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 81.2 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 . . . . . . . . . . . . . 63.7 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 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 12.6 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 . 007 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 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 77.2 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 . . . . . 0.504 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 . 007 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 40.4 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 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 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 . . . . . . . . . . . . . 63.0 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 . 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 72.0 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 . 007 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 . 007 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 69.6 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 91.9 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 77.1 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 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 007 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 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 97.1 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 . 007 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -57.07 -34.97 46.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -76.1 -39.27 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.194 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -62.09 -27.36 68.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.199 173.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.462 ' O ' HG12 ' A' ' 103' ' ' VAL . 38.2 t -92.47 -12.93 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.213 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -78.54 70.26 4.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.156 -168.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 49.29 54.69 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.226 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 37.8 mmt -86.09 -18.39 32.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.208 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.73 -173.47 28.26 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -177.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.49 -38.26 74.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -166.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 76.2 p -73.19 -30.77 63.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.195 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.76 -44.37 89.54 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.0 t -65.01 -45.29 95.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.0 111.212 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.21 -46.15 91.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.194 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.37 90.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.162 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -53.9 -47.44 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.228 175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.1 m -59.5 -40.54 87.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.187 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -53.7 -33.92 57.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 97.4 p -97.0 -5.3 38.06 Favored 'General case' 0 C--N 1.337 0.064 0 O-C-N 121.226 -0.921 . . . . 0.0 111.238 -166.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 69.4 mt -64.02 -41.95 66.04 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.203 -170.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 83.7 Cg_exo -52.54 -47.93 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.705 1.603 . . . . 0.0 111.242 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.09 -31.36 30.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.2 -173.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.9 mt -55.96 -52.12 65.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.202 174.533 . . . . . . . . 1 1 . 1 . 007 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 119.671 -0.812 . . . . 0.0 111.873 -177.718 . . . . . . . . 1 1 . 1 . 007 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 . 007 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 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 21.1 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 . . . . . . . . . . . . . 50.3 mt-10 -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 . . . . . . . . . . . . . 54.9 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 . . . . . . . . . . . . . 94.7 m-20 -58.07 -42.1 84.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.11 -36.3 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.184 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.93 -24.6 66.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.203 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -93.22 4.61 53.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.9 m -85.5 166.22 16.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.176 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.38 -36.47 83.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.235 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 53.8 t-105 -55.33 -46.04 76.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.187 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -67.52 -38.8 84.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.215 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -62.62 -31.24 72.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.205 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -85.21 -50.7 7.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.224 -177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.8 p -128.14 77.88 76.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.239 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -72.12 -26.92 17.55 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 121.735 1.623 . . . . 0.0 111.178 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -50.81 25.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.231 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.4 ttm105 -68.16 -33.44 74.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.225 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.95 -35.65 57.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.157 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 74.7 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 . . . . . . . . . . . . . 94.4 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 . . . . . . . . . . . . . 4.5 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 . . . . . . . . . . . . . 81.9 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 . 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 . . . . . . . . . . . . . 59.8 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 . . . . . . . . . . . . . 90.6 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 . 007 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 . 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 . . . . . . . . . . . . . 96.6 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 . 007 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 . 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 . . . . . . . . . . . . . 51.7 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 . 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 . . . . . . . . . . . . . 11.6 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 . . . . . . . . . . . . . 82.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.8 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 . 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 . . . . . . . . . . . . . 45.7 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 . 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 . . . . . . . . . . . . . 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 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.9 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 . . . . . . . . . . . . . 70.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 89.2 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 . 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 . . . . . . . . . . . . . 66.5 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 . . . . . . . . . . . . . 86.6 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 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.5 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 . . . . . . . . . . . . . 15.0 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 . . . . . . . . . . . . . 99.4 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 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.6 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 77.0 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 . 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 . 008 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 . 008 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 32.4 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 . . . . . . . . . . . . . 51.9 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 . 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 . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.5 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.6 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 76.8 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 . 008 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 . 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 . . . . . . . . . . . . . 94.2 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 . . . . . . . . . . . . . 95.2 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 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.3 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 . 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 . . . . . . . . . . . . . 58.9 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 . 008 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 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.544 HG21 ' HB3' ' A' ' 118' ' ' LEU . 68.8 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 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.1 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 . 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 . . . . . . . . . . . . . 57.7 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 . . . . . . . . . . . . . 97.1 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.0 mt -60.21 -30.92 46.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.188 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -75.15 -34.78 61.65 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.743 0.417 . . . . 0.0 111.19 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.6 mmm -68.68 -21.21 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.222 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.6 t -103.23 -27.11 3.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -63.28 100.12 0.22 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.214 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 52.06 41.48 29.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.202 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 61.0 tpp -90.92 139.9 30.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.194 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -73.23 172.3 50.16 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.796 0.331 . . . . 0.0 111.222 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 94.8 m -59.13 -45.68 90.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.03 -37.08 60.4 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 66.8 t -63.28 -45.86 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.17 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.89 -50.38 72.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.217 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.76 -34.75 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -67.99 -39.32 83.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.175 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.426 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 93.6 m -61.75 -32.04 72.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.184 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -72.19 -15.15 61.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.187 -177.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 79.8 p -116.16 9.42 14.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 -176.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.6 mt -68.57 -40.7 19.7 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.187 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 50.5 Cg_exo -56.0 -50.13 13.31 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 121.739 1.626 . . . . 0.0 111.221 174.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.9 mmt -61.49 -43.12 99.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.58 -47.22 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.191 179.517 . . . . . . . . 1 1 . 1 . 008 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 119.671 -0.812 . . . . 0.0 111.873 -178.971 . . . . . . . . 1 1 . 1 . 008 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 . 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 . . . . . . . . . . . . . 81.6 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 . . . . . . . . . . . . . 19.9 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 . 008 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 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -48.95 -46.19 42.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.19 -38.58 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.167 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.84 -23.27 67.29 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 123.944 0.897 . . . . 0.0 111.205 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -100.15 11.35 39.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.198 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.7 m -104.97 163.43 12.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.188 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -57.96 -38.24 75.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.237 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -53.58 -52.28 60.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.226 -177.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -64.3 -39.46 93.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.221 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -57.31 -39.06 75.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.23 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -76.0 -46.07 31.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.207 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.9 p -131.54 72.13 80.7 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.201 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -73.68 -23.97 16.3 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 121.701 1.601 . . . . 0.0 111.189 -168.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -74.68 -48.78 24.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.232 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -74.18 -37.2 64.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 176.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.36 -41.47 98.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.234 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.157 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 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 . 008 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.1 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 . . . . . . . . . . . . . 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 . 008 nuclear build full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.7 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 26.3 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 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.453 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 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 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 . 009 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 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.2 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 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 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 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 47.1 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 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 . . . . . . . . . . . . . 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 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . 0.505 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 . 009 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 . 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 . . . . . 0.419 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 . . . . . 0.419 ' 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 . 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 . . . . . . . . . . . . . 42.9 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 71.3 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 . . . . . . . . . . . . . 38.0 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 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 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 . . . . . . . . . . . . . 97.7 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 74.4 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 . 009 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 . 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 . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.5 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 . 009 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 . 009 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 . 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 . . . . . 0.474 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.4 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 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.9 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 . . . . . . . . . . . . . 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 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 95.6 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.7 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 . 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 . . . . . 0.453 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.53 -34.87 48.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -74.74 -33.53 62.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.137 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 90.9 mmm -72.32 -14.39 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.191 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 70.9 t -111.34 -22.44 4.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.227 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.63 101.22 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.204 -178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 57.96 32.25 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.211 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 48.7 tpp -78.72 150.07 32.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.212 173.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.24 -168.98 44.87 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 174.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -74.63 -41.78 59.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.324 . . . . 0.0 111.189 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.7 m -65.55 -39.32 91.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.198 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.02 -45.57 93.59 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.5 t -64.32 -41.54 92.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.821 0.343 . . . . 0.0 111.207 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.54 -41.04 98.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.182 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.65 -50.21 73.92 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 120.988 -1.07 . . . . 0.0 111.185 170.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.13 -33.65 72.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.187 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.484 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 86.6 m -65.76 -26.89 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.217 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.75 -19.93 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.198 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 93.7 p -107.03 3.81 26.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.199 -173.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.609 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 60.8 mt -67.78 -39.11 16.91 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.5 Cg_exo -59.62 -41.5 55.64 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 121.711 1.607 . . . . 0.0 111.198 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -71.98 -42.39 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.202 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.19 -48.71 80.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.16 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.873 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 93.4 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 . 009 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 . 009 nuclear build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 55.6 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 . . . . . . . . . . . . . 88.3 m-20 -56.49 -39.5 73.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.215 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.9 mt -73.89 -41.52 62.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.204 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.59 -32.54 71.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.222 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -89.94 2.83 54.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.224 -177.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 69.8 m -85.84 166.28 16.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.178 175.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.84 -33.43 75.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 39.4 t-105 -54.26 -44.71 72.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.217 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -63.34 -42.76 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.23 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -64.04 -34.36 77.84 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -68.23 -49.53 60.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.192 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 43.9 p -135.16 81.26 45.0 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.182 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -66.68 -33.4 35.43 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.708 1.605 . . . . 0.0 111.186 -169.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.46 -53.61 9.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.186 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -61.8 -43.39 98.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.235 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.66 95.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.233 178.49 . . . . . . . . 1 1 . 1 . 009 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 116.178 -0.464 . . . . 0.0 112.157 179.164 . . . . . . . . 1 1 . 1 . 009 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 . 009 nuclear build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.5 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 . 009 nuclear build full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.6 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 . 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 . . . . . . . . . . . . . 5.6 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 40.1 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.485 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 . . . . . . . . . . . . . 51.6 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 . 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 . . . . . 0.431 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 25.1 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 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 101' ' ' ASN . 95.6 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 . 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 . . . . . . . . . . . . . 94.5 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 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.6 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 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.5 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 . . . . . . . . . . . . . 41.8 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 . 010 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 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 88.4 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 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.4 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 15.1 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 . . . . . . . . . . . . . 99.4 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 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.1 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 . 010 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 . 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 . . . . . . . . . . . . . 77.0 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 . 46.3 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 . . . . . . . . . . . . . 85.0 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 . . . . . . . . . . . . . 27.6 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 . 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 52.3 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 . . . . . . . . . . . . . 71.2 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 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 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 . . . . . . . . . . . . . 45.6 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 . 010 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 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 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 . . . . . . . . . . . . . 90.8 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 . 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 . . . . . . . . . . . . . 33.0 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 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.6 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.442 HG21 ' HB3' ' A' ' 118' ' ' LEU . 69.9 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 . . . . . . . . . . . . . 73.8 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 . 010 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 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 83.6 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 . . . . . . . . . . . . . 84.6 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 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.6 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 . . . . . 0.431 ' 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 . 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 . . . . . 0.485 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.41 -46.28 81.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.19 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.482 ' HA ' HD21 ' A' ' 7' ' ' LEU . 13.7 t-20 -59.39 -44.88 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.215 175.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.3 tpp -57.88 -32.77 68.01 Favored 'General case' 0 C--N 1.275 -2.645 0 C-N-CA 125.197 1.399 . . . . 0.0 111.15 -174.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.6 m -108.7 1.47 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -72.07 -44.22 63.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -100.31 -56.48 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.214 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 99.4 mmm -71.59 133.47 45.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.195 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -93.77 -151.73 28.44 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -50.41 -36.49 33.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.766 0.317 . . . . 0.0 111.209 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 88.0 m -56.22 -39.16 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.151 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -84.42 -30.87 26.39 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.7 t -62.98 -31.78 53.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.834 0.349 . . . . 0.0 111.178 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.31 -45.26 80.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.215 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.07 33.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.184 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -62.92 -29.92 71.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.207 177.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 82.4 m -62.24 -27.04 68.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.197 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.72 -19.87 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.161 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.0 m -111.3 0.53 16.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.212 -173.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.585 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 42.2 mt -66.82 -40.84 33.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 61.9 Cg_exo -58.61 -43.28 46.34 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 121.655 1.57 . . . . 0.0 111.212 -178.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.1 mmt -67.24 -42.7 83.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.171 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.42 -46.93 88.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.174 179.624 . . . . . . . . 1 1 . 1 . 010 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 119.671 -0.812 . . . . 0.0 111.873 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.1 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 . . . . . . . . . . . . . 82.2 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 . . . . . . . . . . . . . 19.6 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 . . . . . . . . . . . . . 77.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -65.34 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.32 -33.98 76.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.225 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.72 -14.25 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.207 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -95.04 3.01 55.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.162 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 56.8 p -75.04 160.44 30.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -67.87 -29.53 68.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.225 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 19.7 t-105 -61.95 -45.9 91.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 176.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -64.62 -42.6 95.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.213 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -56.89 -44.01 81.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.196 173.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -69.72 -50.08 47.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.229 -174.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 27.8 m -142.72 79.25 15.17 Favored Pre-proline 0 C--N 1.293 -1.887 0 C-N-CA 123.346 0.658 . . . . 0.0 111.251 -176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.96 -19.22 46.26 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 121.736 1.624 . . . . 0.0 111.235 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.05 -28.06 69.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.231 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -99.84 -39.45 8.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.209 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.48 -35.06 79.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -169.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.157 178.147 . . . . . . . . 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 . . . . . . . . . . . . . 88.2 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 . 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 . . . . . . . . . . . . . 17.1 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 . . . . . . . . . . . . . 35.6 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 . . . . . . . . . . . . . 89.5 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 . 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 . . . . . . . . . . . . . 96.0 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 . . . . . . . . . . . . . 31.5 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . . . . . . . . . 26.2 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 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.487 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 . . . . . . . . . . . . . 55.1 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 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 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 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.1 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 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.7 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 . 001 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 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 93.9 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 . . . . . . . . . . . . . 88.4 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 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 44.4 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 . . . . . . . . . . . . . 78.7 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 . . . . . . . . . . . . . 90.4 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 . 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 . . . . . . . . . . . . . 87.3 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 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 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 88.5 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 . 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 . . . . . . . . . . . . . 60.5 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 . . . . . . . . . . . . . 86.4 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 . . . . . . . . . . . . . 63.4 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 . . . . . . . . . . . . . 89.5 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 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 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 . 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 . . . . . . . . . . . . . 41.0 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.4 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 . 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 . 001 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 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 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 . . . . . 0.419 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 . 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 . . . . . 0.419 ' 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 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.8 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 . . . . . . . . . . . . . 43.1 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 . 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 . . . . . . . . . . . . . 62.5 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 . 001 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 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 89.5 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 . . . . . . . . . . . . . 97.0 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 . . . . . . . . . . . . . 64.9 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 . . . . . 0.4 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 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.9 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 . 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 . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 001 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 . 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 . . . . . . . . . . . . . 79.6 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 . . . . . . . . . . . . . 93.0 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 . . . . . . . . . . . . . 32.3 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 . 001 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 . 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 . . . . . . . . . . . . . 99.7 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 . . . . . . . . . . . . . 97.6 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 . . . . . . . . . . . . . 58.5 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 . . . . . 0.533 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.7 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 59.0 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 . . . . . . . . . . . . . 96.2 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 . 001 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 . 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 . . . . . . . . . . . . . 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 . 001 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 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.5 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 . 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 . . . . . 0.487 HG21 HG12 ' A' ' 3' ' ' ILE . 96.7 mt -55.66 -39.67 56.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.764 0.316 . . . . 0.0 111.186 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -66.75 -47.0 73.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.141 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.0 mmm -61.72 -25.92 67.73 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.217 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.476 ' O ' HG12 ' A' ' 103' ' ' VAL . 44.4 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.561 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.5 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.788 0.328 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 71.4 Cg_exo -56.05 -41.94 71.79 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.678 1.585 . . . . 0.0 111.25 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.478 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.1 mmt -65.77 -42.96 90.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.195 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.32 -51.14 70.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.15 176.83 . . . . . . . . 1 1 . 1 . 001 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 119.671 -0.812 . . . . 0.0 111.873 -174.575 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 001 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 . 001 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 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.478 ' 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 . 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 . . . . . . . . . . . . . 53.3 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 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -65.65 -32.8 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.223 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.28 -34.3 74.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.193 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.16 -15.97 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.238 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.7 mttt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.18 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo . . . . . 0 N--CA 1.458 -0.579 0 N-CA-C 111.212 -0.341 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -69.54 -50.61 43.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.165 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.11 -36.59 84.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.791 0.329 . . . . 0.0 111.203 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.64 -41.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.216 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.157 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 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 . 001 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.4 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 . . . . . . . . . . . . . 96.4 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 . 001 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 17.0 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 . 001 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.4 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 . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 70.9 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 . 001 nuclear nobuild core ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.7 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 . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 41.7 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 . . . . . . . . . . . . . 26.2 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 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.507 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 . 002 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 . 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 . . . . . . . . . . . . . 11.4 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 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.415 HD21 ' HA ' ' A' ' 101' ' ' ASN . 84.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.5 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.0 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 . . . . . . . . . . . . . 64.0 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . 0.505 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 . 002 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 . 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 . . . . . 0.421 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 . 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 . . . . . 0.421 ' 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 . 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 . . . . . . . . . . . . . 48.1 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 25.3 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 93.2 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 99.4 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 . 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 . . . . . . . . . . . . . 58.8 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 . 002 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 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.1 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 . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 002 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . . . -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 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 . . . . . 0.507 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -55.51 -40.45 58.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.769 0.319 . . . . 0.0 111.192 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.415 ' HA ' HD21 ' A' ' 7' ' ' LEU . 52.2 t-20 -65.66 -41.11 92.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.239 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 97.0 mmm -63.79 -33.57 75.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 63.7 t . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.235 178.14 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.601 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 51.1 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.768 0.318 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 49.3 Cg_exo -62.48 -44.32 18.59 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.644 1.563 . . . . 0.0 111.233 -178.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 34.9 mmt -65.96 -40.93 91.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.206 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -59.15 -49.74 76.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.232 176.309 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.717 . . . . . . . . 1 1 . 1 . 002 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 . 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 . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -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 . . . . . . . . . . . . . 53.1 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 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.92 -41.36 64.35 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 . . . . . . . . . . . . . 83.1 mt -75.38 -37.29 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.15 65.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.199 -176.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.0 mttt . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 179.791 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 111.199 -0.347 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -76.1 -48.11 21.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.193 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -74.4 -35.76 63.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.203 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.3 88.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.204 -179.772 . . . . . . . . 1 1 . 1 . 002 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 116.187 -0.461 . . . . 0.0 112.157 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 65.7 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 . . . . . . . . . . . . . 84.0 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 . . . . . . . . . . . . . 83.2 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 . 002 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 . 002 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.2 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 43.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 96.6 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 . 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.2 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 . 003 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 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 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 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.2 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 79.1 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 . . . . . . . . . . . . . 90.6 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 . 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 . . . . . . . . . . . . . 87.2 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.4 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 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 90.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 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 . 003 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 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.0 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 . . . . . . . . . . . . . 99.3 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 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.9 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 . 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 . . . . . . . . . . . . . 29.1 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 . 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 . . . . . . . . . . . . . 48.1 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 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.9 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 . 45.8 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 . 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 . . . . . . . . . . . . . 27.4 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.1 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 . . . . . . . . . . . . . 40.7 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 . . . . . . . . . . . . . 2.9 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 . . . . . . . . . . . . . 90.1 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 . 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 . . . . . . . . . . . . . 68.8 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 64.4 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 . . . . . 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 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.4 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 . . . . . . . . . . . . . 45.6 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 . 003 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 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.5 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . 0.538 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.0 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 . . . . . . . . . . . . . 72.2 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 . 003 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 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 93.0 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 . 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 . . . . . . . . . . . . . 96.3 mt -59.52 -30.04 43.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.815 0.34 . . . . 0.0 111.199 177.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -77.0 -39.27 51.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 177.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 93.1 mmm -60.99 -44.7 97.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.218 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.4 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.233 -178.616 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.591 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 49.2 mt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.781 0.324 . . . . 0.0 111.186 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.591 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 75.4 Cg_exo -56.21 -43.4 56.49 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 121.708 1.605 . . . . 0.0 111.171 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.7 mmt -66.61 -38.32 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.184 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.04 -47.55 74.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.216 178.422 . . . . . . . . 1 1 . 1 . 003 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 119.671 -0.812 . . . . 0.0 111.873 179.722 . . . . . . . . 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 . . . . . . . . . . . . . 81.7 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 . 003 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 003 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 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -64.29 -34.44 78.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.206 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -73.81 -34.74 64.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.238 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -16.48 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.164 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.6 mttt . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.238 178.828 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo . . . . . 0 N--CA 1.458 -0.592 0 N-CA-C 111.167 -0.359 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -70.78 -56.67 5.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.2 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -59.89 -45.15 93.44 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 125.05 1.34 . . . . 0.0 111.165 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -60.91 -43.39 98.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.219 177.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.157 176.966 . . . . . . . . 1 1 . 1 . 003 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 . 003 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.7 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 . . . . . . . . . . . . . 90.2 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 . 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 . . . . . . . . . . . . . 19.8 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.7 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 . 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 . . . . . . . . . . . . . 68.9 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 . . . . . . . . . . . . . 91.0 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 . . . . . . . . . . . . . 95.4 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 30.8 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 . 003 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.44 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 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.1 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 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 17.9 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 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 84.6 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 . 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 . . . . . . . . . . . . . 87.3 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 . 004 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 . 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 . . . . . . . . . . . . . 42.0 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 . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 69.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 65.5 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 . . . . . . . . . . . . . 85.6 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 . 004 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 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 87.8 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 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 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 . . . . . . . . . . . . . 44.6 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . 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 . 004 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 31.2 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 . 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 . . . . . . . . . . . . . 50.8 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 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.7 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 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.3 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.6 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 . 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 . . . . . . . . . . . . . 25.4 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 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.4 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 . . . . . . . . . . . . . 69.0 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 95.2 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 . 004 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 . 004 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 . 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 . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 58.7 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 . . . . . 0.549 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.6 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 . . . . . . . . . . . . . 74.0 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 . . . . . . . . . . . . . 57.4 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 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 7.4 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.5 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 . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -37.03 59.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.407 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 55.1 t-20 -76.6 -32.37 58.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.168 179.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 tpp -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.164 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.214 179.519 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.574 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 47.8 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.775 0.321 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 53.2 Cg_exo -57.37 -42.54 60.83 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.714 1.609 . . . . 0.0 111.207 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -64.91 -43.2 93.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.192 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.68 -47.93 84.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.206 177.061 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -176.649 . . . . . . . . 1 1 . 1 . 004 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 . 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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -61.61 -35.96 79.36 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 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.36 -33.71 67.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 -176.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.64 62.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.19 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 178.456 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo . . . . . 0 N--CA 1.457 -0.629 0 N-CA-C 111.222 -0.338 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.75 -49.48 38.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.238 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -69.66 -37.73 76.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.173 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.75 -37.46 82.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.197 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.9 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 . . . . 0.0 112.157 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 96.3 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 . 004 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.3 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 . 004 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 . 004 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.3 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 . . . . . . . . . . . . . 30.8 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.7 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 . . . . . 0.438 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 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.0 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 9.9 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 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.2 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 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.9 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 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.6 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 . 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 . . . . . . . . . . . . . 78.9 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 . . . . . . . . . . . . . 87.3 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 . 005 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 80.9 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 . . . . . . . . . . . . . 58.6 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 . 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 86.5 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.5 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 87.7 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 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.5 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 . . . . . . . . . . . . . 41.4 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 . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 84.5 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 43.7 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 . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 62.5 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 . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.8 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 . 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 . . . . . . . . . . . . . 99.8 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.0 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 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 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 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 . . . . . 0.466 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 . 005 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.5 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 . 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 . . . . . . . . . . . . . 58.8 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 . 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 . . . . . . . . . . . . . 7.3 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 . 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 . . . . . . . . . . . . . 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 . 005 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 . 005 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 . 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 . . . . . 0.401 ' O ' HG22 ' A' ' 103' ' ' VAL . . . -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 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.438 HG21 HG12 ' A' ' 3' ' ' ILE . 96.2 mt -58.08 -29.24 36.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.788 0.327 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -78.99 -35.59 42.66 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 125.358 1.463 . . . . 0.0 111.212 178.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.2 mmm -70.98 -15.14 62.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.216 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 99' ' ' ALA . 25.6 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 -178.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.551 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 71.4 mt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.798 0.333 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 98.2 Cg_exo -50.33 -46.06 30.89 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.739 1.626 . . . . 0.0 111.185 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.2 mmt -66.05 -41.88 90.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.78 -47.89 83.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.23 -179.287 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.758 . . . . . . . . 1 1 . 1 . 005 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 . 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 . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 94.7 m-20 -65.97 -34.95 79.29 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 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.43 -31.39 67.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 177.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.0 -14.69 63.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.205 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.264 178.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo . . . . . 0 N--CA 1.458 -0.611 0 N-CA-C 111.245 -0.329 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -66.17 -53.48 36.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.158 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.31 -64.49 0.85 Allowed 'General case' 0 C--N 1.319 -0.757 0 O-C-N 122.01 -0.431 . . . . 0.0 111.19 175.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -44.37 -44.0 7.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.243 178.778 . . . . . . . . 1 1 . 1 . 005 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 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 005 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 . 005 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 . 005 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 19.1 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 . 005 nuclear nobuild core ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.2 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 . . . . . . . . . . . . . 82.1 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 . . . . . . . . . . . . . 53.8 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 . . . . . . . . . . . . . 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 . 005 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.1 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 . . . . . . . . . . . . . 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 . 005 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 . 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 . . . . . . . . . . . . . 26.3 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 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.5 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 . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 54.3 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 . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 91.5 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 . . . . . . . . . . . . . 67.0 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 . . . . . . . . . . . . . 45.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 87.2 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 . 006 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 . 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 . . . . . . . . . . . . . 82.8 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 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 14.9 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 . . . . . . . . . . . . . 99.3 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 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 29.0 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 . 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 . . . . . . . . . . . . . 97.5 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 . 006 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 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 . 006 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 . 006 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 . 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 . . . . . 0.417 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 . . . . . 0.417 ' 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.5 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 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 51.9 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 97.7 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 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.7 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 . . . . . . . . . . . . . 71.2 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 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 99.3 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 76.1 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 . 006 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 . 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 . . . . . . . . . . . . . 86.0 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.574 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 . . . . . . . . . . . . . 74.4 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 95.1 mt -61.21 -36.5 73.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.803 0.335 . . . . 0.0 111.186 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 23.0 t-20 -64.09 -45.7 87.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.99 -43.15 73.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.194 179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.239 -174.309 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.608 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 76.5 mt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.784 0.326 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.608 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.1 Cg_exo -60.89 -48.81 9.68 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.682 1.588 . . . . 0.0 111.214 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.411 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.4 mmt -61.65 -45.76 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.02 -46.82 87.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.196 -177.328 . . . . . . . . 1 1 . 1 . 006 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 119.671 -0.812 . . . . 0.0 111.873 -179.491 . . . . . . . . 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 . . . . . . . . . . . . . 93.3 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 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.411 ' 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 . . . . . . . . . . . . . 35.9 t30 -54.27 -44.26 71.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.31 -37.41 68.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.68 -20.19 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.244 -176.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.185 176.838 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo . . . . . 0 N--CA 1.458 -0.583 0 N-CA-C 111.206 -0.344 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -74.15 -45.08 51.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -71.47 -35.86 70.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.67 -35.53 72.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.259 178.61 . . . . . . . . 1 1 . 1 . 006 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 116.175 -0.466 . . . . 0.0 112.157 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 75.2 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 . 006 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 25.2 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 . . . . . . . . . . . . . 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 . 006 nuclear nobuild core ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 34.2 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 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 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.5 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 16.3 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 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.0 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 . . . . . . . . 1 1 . 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 . . . . . . . . . . . . . 94.2 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 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.2 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 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.7 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 . 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 . . . . . . . . . . . . . 45.7 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 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.8 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 . . . . . . . . . . . . . 87.2 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 . 007 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 . 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 . . . . . . . . . . . . . 41.5 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 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 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 . . . . . . . . . . . . . 70.8 mm-40 -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 . . . . . . . . . . . . . 30.3 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 . . . . . . . . . . . . . 85.2 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 . 007 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 81.2 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 . . . . . . . . . . . . . 63.7 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 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 12.6 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 . 007 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 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 77.2 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 . . . . . 0.504 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 . 007 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 40.4 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 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 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 . . . . . . . . . . . . . 63.0 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 . 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 72.0 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 . 007 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 . 007 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 . 007 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 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 69.6 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 91.9 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 77.1 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 . 007 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 007 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 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 97.1 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 . 007 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -57.07 -34.97 46.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -76.1 -39.27 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.194 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -62.09 -27.36 68.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.199 173.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.462 ' O ' HG12 ' A' ' 103' ' ' VAL . 38.2 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.213 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 69.4 mt . . . . . 0 C--O 1.23 0.068 0 CA-C-O 120.805 0.336 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 83.7 Cg_exo -52.54 -47.93 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.705 1.603 . . . . 0.0 111.242 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.09 -31.36 30.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.2 -173.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.9 mt -55.96 -52.12 65.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.202 174.533 . . . . . . . . 1 1 . 1 . 007 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 119.671 -0.812 . . . . 0.0 111.873 -177.718 . . . . . . . . 1 1 . 1 . 007 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 . 007 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 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 21.1 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 . . . . . . . . . . . . . 50.3 mt-10 -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 . . . . . . . . . . . . . 54.9 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 . . . . . . . . . . . . . 94.7 m-20 -58.07 -42.1 84.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.11 -36.3 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.184 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.93 -24.6 66.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.203 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 179.828 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo . . . . . 0 N--CA 1.458 -0.6 0 N-CA-C 111.178 -0.355 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -50.81 25.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.231 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.4 ttm105 -68.16 -33.44 74.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.225 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.95 -35.65 57.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.157 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 74.7 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 . . . . . . . . . . . . . 94.4 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 . . . . . . . . . . . . . 4.5 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 . . . . . . . . . . . . . 81.9 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 . 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 . . . . . . . . . . . . . 59.8 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 . . . . . . . . . . . . . 90.6 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 . 007 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 . 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 . . . . . . . . . . . . . 96.6 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 . 007 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 . 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 . . . . . . . . . . . . . 51.7 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 . 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 . . . . . . . . . . . . . 11.6 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 . . . . . . . . . . . . . 82.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.8 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 . 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 . . . . . . . . . . . . . 45.7 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 . 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.9 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 . . . . . . . . . . . . . 70.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 89.2 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 . 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 . . . . . . . . . . . . . 66.5 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 . . . . . . . . . . . . . 86.6 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 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.5 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 . . . . . . . . . . . . . 15.0 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 . . . . . . . . . . . . . 99.4 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 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.6 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 77.0 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 . 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 . 008 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 . 008 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 32.4 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 . . . . . . . . . . . . . 51.9 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 . 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 . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.5 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.6 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 76.8 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 . 008 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 . 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 . . . . . . . . . . . . . 94.2 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 . . . . . . . . . . . . . 95.2 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 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.3 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 . 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 . . . . . . . . . . . . . 58.9 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 . 008 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 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.544 HG21 ' HB3' ' A' ' 118' ' ' LEU . 68.8 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 . 008 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.1 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 . 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 . . . . . . . . . . . . . 57.7 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 . . . . . . . . . . . . . 97.1 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.0 mt -60.21 -30.92 46.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.188 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -75.15 -34.78 61.65 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.743 0.417 . . . . 0.0 111.19 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.6 mmm -68.68 -21.21 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.222 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -177.34 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.6 mt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 50.5 Cg_exo -56.0 -50.13 13.31 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 121.739 1.626 . . . . 0.0 111.221 174.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.9 mmt -61.49 -43.12 99.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.58 -47.22 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.191 179.517 . . . . . . . . 1 1 . 1 . 008 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 119.671 -0.812 . . . . 0.0 111.873 -178.971 . . . . . . . . 1 1 . 1 . 008 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 . 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 . . . . . . . . . . . . . 81.6 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 . . . . . . . . . . . . . 19.9 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 . 008 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 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.448 HD22 ' C ' ' A' ' 132' ' ' ASN . 0.2 OUTLIER -48.95 -46.19 42.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.19 -38.58 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.167 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.84 -23.27 67.29 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 123.944 0.897 . . . . 0.0 111.205 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.198 -178.632 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo . . . . . 0 N--CA 1.458 -0.592 0 N-CA-C 111.189 -0.35 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -74.68 -48.78 24.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.232 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -74.18 -37.2 64.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 176.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.36 -41.47 98.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.234 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.157 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.1 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild core ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.7 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 26.3 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 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.453 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 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 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 . 009 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 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.2 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 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 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 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 47.1 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 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 . . . . . . . . . . . . . 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 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . 0.505 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 . 009 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 . 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 . . . . . 0.419 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 . . . . . 0.419 ' 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 . 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 . . . . . . . . . . . . . 42.9 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 71.3 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 . . . . . . . . . . . . . 38.0 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 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 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 . . . . . . . . . . . . . 97.7 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 74.4 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 . 009 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 . 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 . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.5 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 . 009 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 . 009 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 . 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 . . . . . 0.474 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.4 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 . 009 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.9 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 . . . . . . . . . . . . . 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 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 95.6 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.7 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 . 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 . . . . . 0.453 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.53 -34.87 48.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -74.74 -33.53 62.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.137 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 90.9 mmm -72.32 -14.39 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.191 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.227 -178.292 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.609 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 60.8 mt . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.774 0.321 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.5 Cg_exo -59.62 -41.5 55.64 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 121.711 1.607 . . . . 0.0 111.198 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -71.98 -42.39 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.202 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.19 -48.71 80.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.16 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.873 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 93.4 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 . 009 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 . 009 nuclear nobuild core ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 55.6 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 . . . . . . . . . . . . . 88.3 m-20 -56.49 -39.5 73.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.215 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.9 mt -73.89 -41.52 62.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.204 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.59 -32.54 71.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.222 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.224 -177.162 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 N--CA 1.458 -0.585 0 N-CA-C 111.186 -0.352 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.46 -53.61 9.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.186 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -61.8 -43.39 98.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.235 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.66 95.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.233 178.49 . . . . . . . . 1 1 . 1 . 009 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 116.178 -0.464 . . . . 0.0 112.157 179.164 . . . . . . . . 1 1 . 1 . 009 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 . 009 nuclear nobuild core ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.5 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 . 009 nuclear nobuild core ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.6 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 . 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 . . . . . . . . . . . . . 5.6 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 40.1 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.485 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 . . . . . . . . . . . . . 51.6 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 . 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 . . . . . 0.431 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 25.1 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 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 101' ' ' ASN . 95.6 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 . 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 . . . . . . . . . . . . . 94.5 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 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.6 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 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.5 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 . . . . . . . . . . . . . 41.8 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 . 010 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 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 88.4 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 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.4 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 15.1 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 . . . . . . . . . . . . . 99.4 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 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.1 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 . 010 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 . 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 . . . . . . . . . . . . . 77.0 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 . 46.3 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 . . . . . . . . . . . . . 85.0 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 . . . . . . . . . . . . . 27.6 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 . 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 52.3 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 . . . . . . . . . . . . . 71.2 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 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 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 . . . . . . . . . . . . . 45.6 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 . 010 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 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 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 . . . . . . . . . . . . . 90.8 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 . 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 . . . . . . . . . . . . . 33.0 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 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.6 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.442 HG21 ' HB3' ' A' ' 118' ' ' LEU . 69.9 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 . . . . . . . . . . . . . 73.8 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 . 010 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 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 83.6 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 . . . . . . . . . . . . . 84.6 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 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.6 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 . . . . . 0.431 ' 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 . 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 . . . . . 0.485 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.41 -46.28 81.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.19 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASN . . . . . 0.482 ' HA ' HD21 ' A' ' 7' ' ' LEU . 13.7 t-20 -59.39 -44.88 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.215 175.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.3 tpp -57.88 -32.77 68.01 Favored 'General case' 0 C--N 1.275 -2.645 0 C-N-CA 125.197 1.399 . . . . 0.0 111.15 -174.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.6 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.542 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.585 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 42.2 mt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.8 0.333 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 61.9 Cg_exo -58.61 -43.28 46.34 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 121.655 1.57 . . . . 0.0 111.212 -178.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.1 mmt -67.24 -42.7 83.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.171 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.42 -46.93 88.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.174 179.624 . . . . . . . . 1 1 . 1 . 010 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 119.671 -0.812 . . . . 0.0 111.873 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.1 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 . . . . . . . . . . . . . 82.2 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 . . . . . . . . . . . . . 19.6 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 . . . . . . . . . . . . . 77.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -65.34 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.32 -33.98 76.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.225 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.72 -14.25 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.207 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.162 -179.408 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo . . . . . 0 N--CA 1.458 -0.591 0 N-CA-C 111.235 -0.333 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.05 -28.06 69.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.231 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -99.84 -39.45 8.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.209 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.48 -35.06 79.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -169.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.157 178.147 . . . . . . . . 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 . . . . . . . . . . . . . 88.2 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 . 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 . . . . . . . . . . . . . 17.1 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 . . . . . . . . . . . . . 35.6 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 . . . . . . . . . . . . . 89.5 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 . 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 . . . . . . . . . . . . . 96.0 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 . . . . . . . . . . . . . 31.5 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . . . . . . . . . 26.2 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 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.487 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 . . . . . . . . . . . . . 55.1 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 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 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 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.1 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 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.7 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 . 001 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 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 93.9 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 . . . . . . . . . . . . . 88.4 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 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 44.4 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 . . . . . . . . . . . . . 78.7 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 . . . . . . . . . . . . . 90.4 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 . 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 . . . . . . . . . . . . . 87.3 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 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 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 88.5 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 . 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 . . . . . . . . . . . . . 60.5 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 . . . . . . . . . . . . . 86.4 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 . . . . . . . . . . . . . 63.4 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 . . . . . . . . . . . . . 89.5 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 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 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 . 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 . . . . . . . . . . . . . 41.0 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 77.4 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 . 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 . 001 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 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.4 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 . . . . . 0.419 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 . 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 . . . . . 0.419 ' 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 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.8 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 . . . . . . . . . . . . . 43.1 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 . 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 . . . . . . . . . . . . . 62.5 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 . 001 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 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 89.5 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 . . . . . . . . . . . . . 97.0 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 . . . . . . . . . . . . . 64.9 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 . . . . . 0.4 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 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 34.9 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 . 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 . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 001 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 . 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 . . . . . . . . . . . . . 79.6 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 . . . . . . . . . . . . . 93.0 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 . . . . . . . . . . . . . 32.3 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 . 001 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 . 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 . . . . . . . . . . . . . 99.7 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 . . . . . . . . . . . . . 97.6 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 . . . . . . . . . . . . . 58.5 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 . . . . . 0.533 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.7 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 59.0 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 . . . . . . . . . . . . . 96.2 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 . 001 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 . 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 . . . . . . . . . . . . . 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 . 001 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 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 90.5 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 . 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 . . . . . 0.487 HG21 HG12 ' A' ' 3' ' ' ILE . 96.7 mt -55.66 -39.67 56.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.764 0.316 . . . . 0.0 111.186 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -66.75 -47.0 73.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.141 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 95.0 mmm -61.72 -25.92 67.73 Favored 'General case' 0 C--N 1.388 2.257 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.217 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.476 ' O ' HG12 ' A' ' 103' ' ' VAL . 44.4 t -95.04 -12.35 8.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -73.78 103.73 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.198 -172.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 55.25 34.85 23.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.184 177.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 59.2 tpp -87.46 147.08 25.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.168 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.04 162.64 48.68 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.31 -35.08 79.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 111.185 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.9 m -70.65 -40.47 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.172 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.97 -45.37 95.27 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 174.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.0 t -65.22 -42.77 94.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 111.22 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.06 81.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.175 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.84 -34.71 71.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.206 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -66.79 -36.26 81.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.196 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.407 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 83.6 m -57.59 -33.7 68.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.183 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -68.39 -19.88 64.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.168 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 71.2 m -100.65 -0.73 36.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.197 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.561 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.5 mt -64.89 -40.97 51.94 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.197 -175.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 71.4 Cg_exo -56.05 -41.94 71.79 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.678 1.585 . . . . 0.0 111.25 -178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.478 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.1 mmt -65.77 -42.96 90.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.195 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 93.3 mt -57.32 -51.14 70.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.15 176.83 . . . . . . . . 1 1 . 1 . 001 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 119.671 -0.812 . . . . 0.0 111.873 -174.575 . . . . . . . . 1 1 . 1 . 001 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 . 001 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 . 001 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 . 001 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 001 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 . 001 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 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.478 ' 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 . 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 . . . . . . . . . . . . . 53.3 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 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -65.65 -32.8 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.223 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.28 -34.3 74.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.193 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.16 -15.97 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.238 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -83.41 -8.75 59.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.197 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 78.1 p -74.25 161.08 30.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.216 -171.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -65.1 -34.75 79.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.212 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -54.4 -42.32 70.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.196 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -66.64 -42.35 86.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.195 -178.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -61.11 -39.89 91.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.173 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -73.87 -48.61 29.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.213 -177.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 44.7 p -134.35 81.94 48.08 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.219 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -58.94 -34.81 99.28 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 121.682 1.588 . . . . 0.0 111.212 -174.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -69.54 -50.61 43.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.165 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.11 -36.59 84.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.791 0.329 . . . . 0.0 111.203 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.64 -41.32 75.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.216 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.157 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 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 . 001 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 88.4 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 . . . . . . . . . . . . . 96.4 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 . 001 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 17.0 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 . 001 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 80.4 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 . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 70.9 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 . 001 nuclear nobuild full ' A' A ' 158' ' ' TRP . . . . . . . . . . . . . 90.7 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 . . . . . . . . . . . . . 95.3 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 41.7 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 . . . . . . . . . . . . . 26.2 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 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.507 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 . 002 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 . 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 . . . . . . . . . . . . . 11.4 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 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.415 HD21 ' HA ' ' A' ' 101' ' ' ASN . 84.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 73.5 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.0 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 . . . . . . . . . . . . . 64.0 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . 0.505 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 . 002 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 . 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 . . . . . 0.421 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 . 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 . . . . . 0.421 ' 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 . 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 . . . . . . . . . . . . . 48.1 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 25.3 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 93.2 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 99.4 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 . 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 . . . . . . . . . . . . . 58.8 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 . 002 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 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 118' ' ' LEU . 73.1 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 . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 002 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . 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 . 002 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 . 002 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 . 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 . . . . . . . . . . . . . . . -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 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 . . . . . 0.507 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -55.51 -40.45 58.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.769 0.319 . . . . 0.0 111.192 177.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.415 ' HA ' HD21 ' A' ' 7' ' ' LEU . 52.2 t-20 -65.66 -41.11 92.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.239 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 97.0 mmm -63.79 -33.57 75.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 63.7 t -86.58 -17.92 8.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.235 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -71.9 75.05 0.89 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 49.35 56.36 7.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.235 172.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 63.3 tpp -95.71 -14.28 23.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.229 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.71 164.57 24.26 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.29 -33.4 75.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.799 0.333 . . . . 0.0 111.222 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 96.4 m -64.63 -41.88 95.87 Favored 'General case' 0 N--CA 1.457 -0.083 0 O-C-N 122.137 -0.352 . . . . 0.0 111.221 177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.98 -41.72 93.07 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 56.1 t -64.48 -43.95 96.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.799 0.333 . . . . 0.0 111.176 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.13 83.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -68.47 -39.41 81.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.179 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.412 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 93.9 m -58.99 -37.38 76.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.193 178.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -66.05 -24.66 66.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.181 -175.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.5 p -102.56 3.91 37.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.198 -171.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.601 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 51.1 mt -67.84 -39.92 20.87 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.221 -173.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.601 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 49.3 Cg_exo -62.48 -44.32 18.59 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.644 1.563 . . . . 0.0 111.233 -178.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 34.9 mmt -65.96 -40.93 91.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.206 177.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -59.15 -49.74 76.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.232 176.309 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.717 . . . . . . . . 1 1 . 1 . 002 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 . 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 . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -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 . . . . . . . . . . . . . 53.1 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 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -52.92 -41.36 64.35 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 . . . . . . . . . . . . . 83.1 mt -75.38 -37.29 60.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 178.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.97 -24.15 65.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.199 -176.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -98.28 11.46 37.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 58.0 m -94.63 161.93 14.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.229 178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -60.34 -31.7 70.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.238 177.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -56.25 -52.96 62.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.192 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -62.71 -35.61 80.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.202 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -66.88 -26.86 67.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.193 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -84.45 -45.35 12.77 Favored 'General case' 0 C--N 1.395 2.547 0 O-C-N 119.583 -1.948 . . . . 0.0 111.17 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 43.7 p -131.65 73.14 79.57 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.217 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -67.21 -23.29 45.53 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 121.721 1.614 . . . . 0.0 111.199 -176.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -76.1 -48.11 21.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.193 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -74.4 -35.76 63.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.203 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.3 88.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.204 -179.772 . . . . . . . . 1 1 . 1 . 002 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 116.187 -0.461 . . . . 0.0 112.157 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 65.7 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 . . . . . . . . . . . . . 84.0 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 . . . . . . . . . . . . . 83.2 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 . 002 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 . 002 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 26.2 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 . . . . . . . . . . . . . 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 . 002 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 43.0 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 . . . . . . . . . . . . . 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 . 002 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 . 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 . . . . . . . . . . . . . 96.6 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 . 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 . . . . . . . . . . . . . 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 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.2 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 . 003 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 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 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 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.2 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.8 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 . 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 . . . . . . . . . . . . . 79.1 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 . . . . . . . . . . . . . 90.6 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 . 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 . . . . . . . . . . . . . 87.2 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.4 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 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.4 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 90.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.9 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 . 003 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 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.0 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 . . . . . . . . . . . . . 99.3 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 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.9 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 . 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 . . . . . . . . . . . . . 29.1 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 . 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 . . . . . . . . . . . . . 48.1 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 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.9 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 . 45.8 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 . 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 . . . . . . . . . . . . . 27.4 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 56.1 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 . . . . . . . . . . . . . 40.7 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 . . . . . . . . . . . . . 2.9 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 . . . . . . . . . . . . . 90.1 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 . 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 . . . . . . . . . . . . . 68.8 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 64.4 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 . . . . . 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 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.4 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 . . . . . . . . . . . . . 45.6 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 . 003 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 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.5 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 . 003 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 . 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 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 . 003 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 . 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 . . . . . 0.538 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.0 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 . . . . . . . . . . . . . 72.2 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 . 003 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 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 59.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 93.0 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 . 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 . . . . . 0.443 ' O ' ' HB2' ' A' ' 104' ' ' PHE . 96.3 mt -59.52 -30.04 43.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.815 0.34 . . . . 0.0 111.199 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -77.0 -39.27 51.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.177 177.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 93.1 mmm -60.99 -44.7 97.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.218 178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.4 m -77.24 -18.47 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.233 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' A' ' 100' ' ' ILE . 63.9 t80 -67.76 83.29 0.19 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.214 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 44.62 66.0 0.96 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.146 171.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 57.4 ttm -115.23 -30.03 6.42 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 123.44 0.696 . . . . 0.0 111.16 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.33 147.83 5.94 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.19 -0.764 . . . . 0.0 111.19 -177.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -70.43 -32.38 69.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 111.198 -177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 79.0 p -74.06 -27.25 60.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.193 175.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -70.17 -40.17 71.65 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.6 t -68.92 -40.45 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.781 0.325 . . . . 0.0 111.187 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.77 -46.0 92.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.196 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.12 89.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 175.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -62.41 -35.29 78.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.227 174.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.447 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 96.2 m -64.78 -36.75 85.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.166 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -72.28 -11.25 60.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.225 -177.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.0 m -114.98 15.8 17.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.156 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.591 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 49.2 mt -74.44 -39.24 3.76 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.186 178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.591 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 75.4 Cg_exo -56.21 -43.4 56.49 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 121.708 1.605 . . . . 0.0 111.171 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.7 mmt -66.61 -38.32 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.184 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.04 -47.55 74.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.216 178.422 . . . . . . . . 1 1 . 1 . 003 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 119.671 -0.812 . . . . 0.0 111.873 179.722 . . . . . . . . 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 . . . . . . . . . . . . . 81.7 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 . 003 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 18.9 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 . 003 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 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -64.29 -34.44 78.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.206 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -73.81 -34.74 64.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.238 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.23 -16.48 63.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.164 -176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -94.32 10.62 33.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.238 178.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 83.3 p -69.09 164.84 21.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -76.74 -35.89 57.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.222 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 76.5 t-105 -65.6 -32.7 74.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.173 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -50.22 -35.1 25.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.154 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.8 -41.2 95.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.196 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -71.74 -48.76 44.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.186 -175.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.7 p -132.08 74.55 76.45 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.166 -178.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.74 -30.28 84.66 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 121.715 1.61 . . . . 0.0 111.167 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -70.78 -56.67 5.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.2 -177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -59.89 -45.15 93.44 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 125.05 1.34 . . . . 0.0 111.165 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -60.91 -43.39 98.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.219 177.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.157 176.966 . . . . . . . . 1 1 . 1 . 003 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 . 003 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 77.7 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 . . . . . . . . . . . . . 90.2 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 . 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 . . . . . . . . . . . . . 19.8 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 . . . . . . . . . . . . . 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 . 003 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.7 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 . 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 . . . . . . . . . . . . . 68.9 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 . . . . . . . . . . . . . 91.0 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 . . . . . . . . . . . . . 95.4 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 30.8 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 . 003 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.44 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 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 53.1 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 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 17.9 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 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 59.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 84.6 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 . 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 . . . . . . . . . . . . . 87.3 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 . 004 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 . 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 . . . . . . . . . . . . . 42.0 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 . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 69.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 65.5 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 . . . . . . . . . . . . . 85.6 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 . 004 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 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 87.8 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 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 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 . . . . . . . . . . . . . 44.6 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . 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 . 004 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 31.2 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 . 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 . . . . . . . . . . . . . 50.8 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 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.7 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 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.3 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 37.6 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 . 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 . . . . . . . . . . . . . 25.4 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 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 97.4 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 . . . . . . . . . . . . . 69.0 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 95.2 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 . 004 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 . 004 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 . 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 . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 58.7 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 . . . . . 0.549 HG21 ' HB3' ' A' ' 118' ' ' LEU . 77.6 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 . . . . . . . . . . . . . 74.0 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 . . . . . . . . . . . . . 57.4 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 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 7.4 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 . 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 . . . . . . . . . . . . . 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 . 004 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 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.5 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 . . . . . 0.44 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -58.08 -37.03 59.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.407 ' OD1' ' O ' ' A' ' 101' ' ' ASN . 55.1 t-20 -76.6 -32.37 58.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.168 179.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 tpp -64.93 -37.74 88.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.164 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.6 m -96.86 8.53 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.214 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -77.97 79.41 4.44 Favored 'General case' 0 C--N 1.4 2.772 0 O-C-N 120.637 -1.289 . . . . 0.0 111.221 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 55.17 45.36 26.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.203 174.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 55.1 ttm -86.13 -27.16 24.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.184 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.06 162.36 14.41 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.01 -41.7 97.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.835 0.35 . . . . 0.0 111.225 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 99.9 m -58.33 -44.5 88.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.205 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.85 -44.2 97.8 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.1 t -64.01 -36.09 75.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 111.178 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.33 -50.19 74.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.229 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.71 -36.98 83.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.179 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -63.88 -35.82 81.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.192 178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.505 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 76.9 m -61.04 -34.39 74.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.239 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.62 -9.3 58.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.224 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.0 m -111.9 8.91 20.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.173 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.574 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 47.8 mt -72.03 -40.82 8.15 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.198 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 53.2 Cg_exo -57.37 -42.54 60.83 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.714 1.609 . . . . 0.0 111.207 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.3 mmt -64.91 -43.2 93.61 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.192 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 84.4 mt -60.68 -47.93 84.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.206 177.061 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -176.649 . . . . . . . . 1 1 . 1 . 004 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 . 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 . . . . . . . . . . . . . 19.7 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 . . . . . . . . . . . . . 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 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 75.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -61.61 -35.96 79.36 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 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.36 -33.71 67.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 -176.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.64 62.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.19 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -84.24 -0.0 50.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.215 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 72.3 p -73.8 163.85 27.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.191 -176.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 80.8 ttt180 -70.61 -41.31 72.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.205 176.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -54.24 -40.99 68.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.23 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -61.26 -29.02 69.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -69.16 -38.33 78.68 Favored 'General case' 1 C--N 1.433 4.201 0 O-C-N 119.236 -2.165 . . . . 0.0 111.203 -179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -85.53 -39.5 17.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.235 -176.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.9 p -132.49 74.8 74.85 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.195 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.05 -28.94 48.98 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 121.673 1.582 . . . . 0.0 111.222 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -71.75 -49.48 38.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.238 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -69.66 -37.73 76.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.173 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -67.75 -37.46 82.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.197 174.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.9 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 . . . . 0.0 112.157 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 96.3 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 . 004 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 16.3 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 . 004 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 . 004 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 79.3 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 . . . . . . . . . . . . . 30.8 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 . . . . . . . . . . . . . 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 . 004 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.7 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 . . . . . 0.438 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 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.0 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 9.9 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 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.0 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 . . . . . . . . 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 . . . . . . . . . . . . . 94.2 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 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.9 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 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.6 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 . 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 . . . . . . . . . . . . . 78.9 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 . . . . . . . . . . . . . 87.3 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 . 005 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 . 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 . . . . . . . . . . . . . 42.4 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 . . . . . . . . . . . . . 80.9 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 . . . . . . . . . . . . . 58.6 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 . 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 . . . . . . . . . . . . . 30.0 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 . . . . . . . . . . . . . 86.5 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.5 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 87.7 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 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.5 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 . . . . . . . . . . . . . 41.4 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 . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 84.5 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 . 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 . . . . . 0.418 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 . 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 43.7 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 . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 62.5 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 . . . . . . . . . . . . . 87.8 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 71.1 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 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.8 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 . 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 . . . . . . . . . . . . . 99.8 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 . 005 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 . 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 . . . . . . . . . . . . . . . -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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 85.0 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 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 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.7 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 . . . . . 0.466 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 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.5 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 . 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 . . . . . . . . . . . . . 58.8 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 . 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 . . . . . . . . . . . . . 7.3 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 . 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 . . . . . . . . . . . . . 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 . 005 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 . 005 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 . 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 . . . . . 0.401 ' O ' HG22 ' A' ' 103' ' ' VAL . . . -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 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.438 HG21 HG12 ' A' ' 3' ' ' ILE . 96.2 mt -58.08 -29.24 36.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.788 0.327 . . . . 0.0 111.177 177.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -78.99 -35.59 42.66 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 125.358 1.463 . . . . 0.0 111.212 178.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.2 mmm -70.98 -15.14 62.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.216 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 99' ' ' ALA . 25.6 m -120.81 11.45 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.225 -178.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -80.53 73.34 7.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.197 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 57.47 37.82 27.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.216 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 56.9 tpp -71.33 -28.65 64.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.122 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.5 155.01 23.18 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.0 -37.17 78.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.794 0.331 . . . . 0.0 111.232 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 97.9 m -63.43 -42.35 98.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.196 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.89 -42.65 96.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 176.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 64.1 t -60.52 -43.09 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.753 0.311 . . . . 0.0 111.182 178.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.29 -35.06 68.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.215 -173.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.66 -37.64 88.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.217 169.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -68.32 -34.78 76.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.18 176.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.7 m -62.86 -33.85 76.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -176.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.7 -26.72 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.2 -178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.7 m -101.01 3.42 41.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.195 -168.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.551 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 71.4 mt -66.67 -40.57 32.95 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.216 -173.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.551 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 98.2 Cg_exo -50.33 -46.06 30.89 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.739 1.626 . . . . 0.0 111.185 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.2 mmt -66.05 -41.88 90.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.194 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.78 -47.89 83.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.23 -179.287 . . . . . . . . 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 119.671 -0.812 . . . . 0.0 111.873 -179.758 . . . . . . . . 1 1 . 1 . 005 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 . 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 . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 94.7 m-20 -65.97 -34.95 79.29 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 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.43 -31.39 67.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 177.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.0 -14.69 63.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.205 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -92.44 7.32 43.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.264 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 76.9 p -73.23 160.84 31.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.228 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -70.42 -34.94 73.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.191 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -65.58 -35.15 80.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.188 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -55.83 -47.43 77.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.21 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -65.67 -35.43 80.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.206 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -67.87 -47.32 69.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.198 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 55.2 p -134.47 79.91 52.96 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.195 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -60.79 -38.57 69.54 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 121.704 1.602 . . . . 0.0 111.245 -173.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -66.17 -53.48 36.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.158 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.31 -64.49 0.85 Allowed 'General case' 0 C--N 1.319 -0.757 0 O-C-N 122.01 -0.431 . . . . 0.0 111.19 175.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -44.37 -44.0 7.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.243 178.778 . . . . . . . . 1 1 . 1 . 005 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 116.184 -0.462 . . . . 0.0 112.157 179.562 . . . . . . . . 1 1 . 1 . 005 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 . 005 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 . 005 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 19.1 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 . 005 nuclear nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 56.2 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 . . . . . . . . . . . . . 82.1 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 . . . . . . . . . . . . . 53.8 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 . . . . . . . . . . . . . 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 . 005 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 95.1 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 . . . . . . . . . . . . . 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 . 005 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 . 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 . . . . . . . . . . . . . 26.3 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 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.5 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 . . . . . 0.432 HD21 ' HA ' ' A' ' 101' ' ' ASN . 54.3 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 . 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 91.5 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 . . . . . . . . . . . . . 67.0 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 . . . . . . . . . . . . . 45.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 87.2 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 . 006 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 . 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 . . . . . . . . . . . . . 82.8 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 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 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 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 14.9 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 . . . . . . . . . . . . . 99.3 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 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 29.0 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 . 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 . . . . . . . . . . . . . 97.5 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 . 006 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 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 . 006 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 . 006 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 . 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 . . . . . 0.417 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 . . . . . 0.417 ' 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.5 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 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 51.9 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 97.7 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 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.7 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 . . . . . . . . . . . . . 71.2 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 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.0 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 . 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 . . . . . . . . . . . . . 99.3 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 76.1 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 . 006 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 . 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 . . . . . . . . . . . . . 86.0 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 . 006 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 96.5 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.574 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 . . . . . . . . . . . . . 74.4 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 006 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 . 006 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 . 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 95.1 mt -61.21 -36.5 73.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.803 0.335 . . . . 0.0 111.186 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 7' ' ' LEU . 23.0 t-20 -64.09 -45.7 87.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.169 176.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 94.6 mmm -54.99 -43.15 73.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.194 179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.4 m -100.83 20.64 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.239 -174.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -75.35 -40.98 57.63 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 117.809 -1.556 . . . . 0.0 111.182 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -80.81 -20.05 43.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 172.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 54.0 mtt 56.43 38.29 29.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.51 154.48 45.77 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.225 -0.75 . . . . 0.0 111.225 -176.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.27 -44.62 87.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.82 0.343 . . . . 0.0 111.216 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 98.7 m -69.32 -40.19 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.226 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.22 -48.87 75.71 Favored Glycine 0 CA--C 1.523 0.55 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.45 -43.2 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.849 0.357 . . . . 0.0 111.211 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.06 -46.86 88.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.203 -177.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.24 84.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.218 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -65.08 -34.61 78.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 -177.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.451 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 76.6 m -66.65 -26.34 67.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.148 -178.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -85.81 -8.33 58.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.244 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 83.1 p -99.63 -0.62 39.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.608 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 76.5 mt -68.71 -39.17 13.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.203 -170.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.608 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.1 Cg_exo -60.89 -48.81 9.68 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.682 1.588 . . . . 0.0 111.214 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.411 ' HB3' ' HB2' ' A' ' 129' ' ' ALA . 36.4 mmt -61.65 -45.76 92.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.9 mt -62.02 -46.82 87.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.196 -177.328 . . . . . . . . 1 1 . 1 . 006 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 119.671 -0.812 . . . . 0.0 111.873 -179.491 . . . . . . . . 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 . . . . . . . . . . . . . 93.3 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 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 81.8 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 . . . . . . . . . . . . . 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 . 006 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.411 ' 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 . . . . . . . . . . . . . 35.9 t30 -54.27 -44.26 71.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.31 -37.41 68.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.68 -20.19 62.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.244 -176.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.05 6.13 45.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.185 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.2 m -90.18 166.2 13.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.176 176.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.84 -36.91 84.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.194 -176.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -53.61 -38.7 64.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.179 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -73.27 -26.48 61.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.174 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -75.91 -30.68 58.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.201 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -84.88 -38.07 19.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.19 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 72.4 p -132.95 72.17 77.17 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.187 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -73.38 -33.22 7.26 Favored 'Trans proline' 0 C--N 1.359 1.131 0 C-N-CA 121.266 1.31 . . . . 0.0 111.206 -169.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -74.15 -45.08 51.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.241 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -71.47 -35.86 70.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.178 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.67 -35.53 72.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.259 178.61 . . . . . . . . 1 1 . 1 . 006 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 116.175 -0.466 . . . . 0.0 112.157 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 75.2 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 . 006 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 89.1 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 . . . . . . . . . . . . . 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 . 006 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 . 006 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 25.2 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 . . . . . . . . . . . . . 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 . 006 nuclear nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 81.5 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 . . . . . . . . . . . . . 34.2 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 . . . . . . . . . . . . . 90.8 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 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 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 50.5 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 . . . . . . . . . . . . . 91.9 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 . . . . . . . . . . . . . 16.3 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 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.0 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 . . . . . . . . 1 1 . 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 . . . . . . . . . . . . . 94.2 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 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 87.2 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 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.7 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 . 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 . . . . . . . . . . . . . 45.7 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 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 78.8 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 . . . . . . . . . . . . . 87.2 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 . 007 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 . 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 . . . . . . . . . . . . . 41.5 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 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 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 . . . . . . . . . . . . . 70.8 mm-40 -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 . . . . . . . . . . . . . 30.3 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 . . . . . . . . . . . . . 85.2 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 . 007 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 . 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 . . . . . . . . . . . . . 65.7 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 . 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 . . . . . . . . . . . . . 81.2 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 . . . . . . . . . . . . . 63.7 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 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.0 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 . . . . . . . . . . . . . 12.6 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 . 007 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 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.3 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 77.2 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 . . . . . 0.504 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 . 007 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 40.4 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 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.3 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 . . . . . . . . . . . . . 63.0 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 . 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 . . . . . . . . . . . . . 99.4 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 . . . . . . . . . . . . . 64.8 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 . . . . . . . . . . . . . 72.0 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 . 007 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 . 007 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 . 007 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 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.2 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 . . . . . . . . . . . . . 69.6 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 91.9 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 . 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 . . . . . . . . . . . . . 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 . 007 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 . 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 . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 58.7 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 . . . . . . . . . . . . . 77.1 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 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.0 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 . . . . . . . . . . . . . 99.3 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 . 007 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 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 97.1 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 . 007 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.465 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -57.07 -34.97 46.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.195 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -76.1 -39.27 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.194 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 96.0 mmm -62.09 -27.36 68.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.199 173.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.462 ' O ' HG12 ' A' ' 103' ' ' VAL . 38.2 t -92.47 -12.93 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.213 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -78.54 70.26 4.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.156 -168.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 49.29 54.69 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.226 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 37.8 mmt -86.09 -18.39 32.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.208 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.73 -173.47 28.26 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -177.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.49 -38.26 74.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -166.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 76.2 p -73.19 -30.77 63.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.195 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.76 -44.37 89.54 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.0 t -65.01 -45.29 95.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.802 0.334 . . . . 0.0 111.212 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.21 -46.15 91.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.194 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.37 90.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.162 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -53.9 -47.44 71.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.228 175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.1 m -59.5 -40.54 87.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.187 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -53.7 -33.92 57.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 97.4 p -97.0 -5.3 38.06 Favored 'General case' 0 C--N 1.337 0.064 0 O-C-N 121.226 -0.921 . . . . 0.0 111.238 -166.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 69.4 mt -64.02 -41.95 66.04 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.203 -170.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 83.7 Cg_exo -52.54 -47.93 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 121.705 1.603 . . . . 0.0 111.242 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.4 mmt -82.09 -31.36 30.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.2 -173.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.9 mt -55.96 -52.12 65.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.202 174.533 . . . . . . . . 1 1 . 1 . 007 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 119.671 -0.812 . . . . 0.0 111.873 -177.718 . . . . . . . . 1 1 . 1 . 007 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 . 007 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 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -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 . . . . . . . . . . . . . 21.1 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 . . . . . . . . . . . . . 50.3 mt-10 -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 . . . . . . . . . . . . . 54.9 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 . . . . . . . . . . . . . 94.7 m-20 -58.07 -42.1 84.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.216 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.11 -36.3 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.184 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.93 -24.6 66.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.203 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -93.22 4.61 53.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.9 m -85.5 166.22 16.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.176 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.38 -36.47 83.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.235 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 53.8 t-105 -55.33 -46.04 76.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.187 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -67.52 -38.8 84.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.215 177.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -62.62 -31.24 72.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.205 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -85.21 -50.7 7.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.224 -177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.8 p -128.14 77.88 76.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.239 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -72.12 -26.92 17.55 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 121.735 1.623 . . . . 0.0 111.178 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.99 -50.81 25.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.231 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.4 ttm105 -68.16 -33.44 74.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.225 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -76.95 -35.65 57.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.236 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.178 -0.464 . . . . 0.0 112.157 177.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 74.7 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 . . . . . . . . . . . . . 94.4 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 . . . . . . . . . . . . . 4.5 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 . . . . . . . . . . . . . 81.9 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 . 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 . . . . . . . . . . . . . 59.8 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 . . . . . . . . . . . . . 90.6 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 . 007 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 . 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 . . . . . . . . . . . . . 96.6 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 . 007 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 . 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 . . . . . . . . . . . . . 51.7 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 . 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 . . . . . . . . . . . . . 11.6 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 . . . . . . . . . . . . . 82.9 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 . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.8 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 . 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 . . . . . . . . . . . . . 45.7 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 . 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.9 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 . . . . . . . . . . . . . 70.9 mm-40 -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 . . . . . . . . . . . . . 30.2 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 . . . . . . . . . . . . . 89.2 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 . 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 . . . . . . . . . . . . . 66.5 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 . . . . . . . . . . . . . 86.6 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 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.5 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 . . . . . . . . . . . . . 15.0 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 . . . . . . . . . . . . . 99.4 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 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.6 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 77.0 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 . 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 . 008 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 . 008 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 . 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 . . . . . 0.418 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 . . . . . 0.418 ' 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 . 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 . . . . . . . . . . . . . 32.4 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 . . . . . . . . . . . . . 51.9 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 . 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 . . . . . 0.4 HD11 HD11 ' A' ' 50' ' ' ILE . 72.5 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 98.6 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 76.8 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 . 008 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 . 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 . . . . . . . . . . . . . 94.2 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 . . . . . . . . . . . . . 95.2 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 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.3 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 . 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 . . . . . . . . . . . . . 58.9 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 . 008 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 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.544 HG21 ' HB3' ' A' ' 118' ' ' LEU . 68.8 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 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 74.1 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 . 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 . . . . . . . . . . . . . 57.7 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 . . . . . . . . . . . . . 97.1 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.0 mt -60.21 -30.92 46.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.774 0.321 . . . . 0.0 111.188 177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -75.15 -34.78 61.65 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 122.743 0.417 . . . . 0.0 111.19 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 91.6 mmm -68.68 -21.21 64.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.222 176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.6 t -103.23 -27.11 3.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.163 -177.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -63.28 100.12 0.22 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.214 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 52.06 41.48 29.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.202 178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 61.0 tpp -90.92 139.9 30.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.194 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -73.23 172.3 50.16 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.796 0.331 . . . . 0.0 111.222 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 94.8 m -59.13 -45.68 90.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.157 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.03 -37.08 60.4 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 66.8 t -63.28 -45.86 97.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.17 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.89 -50.38 72.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.217 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.76 -34.75 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.229 -177.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 30.7 t80 -67.99 -39.32 83.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.175 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.426 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 93.6 m -61.75 -32.04 72.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.184 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -72.19 -15.15 61.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.187 -177.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 79.8 p -116.16 9.42 14.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 -176.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 50.6 mt -68.57 -40.7 19.7 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.187 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 50.5 Cg_exo -56.0 -50.13 13.31 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 121.739 1.626 . . . . 0.0 111.221 174.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 36.9 mmt -61.49 -43.12 99.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.204 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.58 -47.22 84.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.191 179.517 . . . . . . . . 1 1 . 1 . 008 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 119.671 -0.812 . . . . 0.0 111.873 -178.971 . . . . . . . . 1 1 . 1 . 008 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 . 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 . . . . . . . . . . . . . 81.6 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 . . . . . . . . . . . . . 19.9 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 . 008 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 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.2 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 . . . . . . . . . . . . . 53.3 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 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.448 HD22 ' C ' ' A' ' 132' ' ' ASN . 0.2 OUTLIER -48.95 -46.19 42.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.19 -38.58 63.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.167 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.84 -23.27 67.29 Favored 'General case' 0 C--N 1.313 -1.012 0 C-N-CA 123.944 0.897 . . . . 0.0 111.205 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -100.15 11.35 39.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.198 -178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.7 m -104.97 163.43 12.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.188 -175.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -57.96 -38.24 75.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.237 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -53.58 -52.28 60.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.226 -177.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -64.3 -39.46 93.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.221 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -57.31 -39.06 75.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.23 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -76.0 -46.07 31.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.207 -175.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.9 p -131.54 72.13 80.7 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.201 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -73.68 -23.97 16.3 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 121.701 1.601 . . . . 0.0 111.189 -168.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -74.68 -48.78 24.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.232 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -74.18 -37.2 64.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 176.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.36 -41.47 98.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.234 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.157 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 96.3 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 87.1 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 . . . . . . . . . . . . . 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 . 008 nuclear nobuild full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 6.7 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 . . . . . . . . . . . . . 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 . 008 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 . 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 . . . . . . . . . . . . . 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 . 008 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 . 008 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 26.3 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 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.453 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 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 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 . 009 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 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.2 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 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.5 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 . . . . . . . . . . . . . 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 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 94.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 47.1 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 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 . . . . . . . . . . . . . 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 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . . . . . . . . . . . . . 66.3 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 . 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.3 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 42.7 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . 0.505 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 . 009 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 . 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 . . . . . 0.419 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 . . . . . 0.419 ' 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 . 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 . . . . . . . . . . . . . 42.9 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 71.3 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 . . . . . . . . . . . . . 38.0 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 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 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 . . . . . . . . . . . . . 97.7 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 . 009 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 . 009 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 . 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 . . . . . . . . . . . . . 74.4 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 . 009 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 . 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 . . . . . . . . . . . . . 87.8 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 . 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 . . . . . . . . . . . . . 33.1 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 . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.5 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 . 009 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 . 009 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 . 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 . . . . . 0.474 HG21 ' HB3' ' A' ' 118' ' ' LEU . 70.4 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 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 73.9 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 . . . . . . . . . . . . . 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 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 95.6 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 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 . 009 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 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.7 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 . 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 . . . . . 0.453 HG21 HG12 ' A' ' 3' ' ' ILE . 96.3 mt -57.53 -34.87 48.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 177.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -74.74 -33.53 62.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.137 179.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 90.9 mmm -72.32 -14.39 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.191 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 70.9 t -111.34 -22.44 4.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.227 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.63 101.22 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.204 -178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 57.96 32.25 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.211 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 48.7 tpp -78.72 150.07 32.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.212 173.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.24 -168.98 44.87 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 174.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -74.63 -41.78 59.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.779 0.324 . . . . 0.0 111.189 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 95.7 m -65.55 -39.32 91.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.198 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.02 -45.57 93.59 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.5 t -64.32 -41.54 92.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.821 0.343 . . . . 0.0 111.207 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.54 -41.04 98.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.182 -179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.65 -50.21 73.92 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 120.988 -1.07 . . . . 0.0 111.185 170.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.13 -33.65 72.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.187 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.484 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 86.6 m -65.76 -26.89 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.217 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.75 -19.93 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.198 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 93.7 p -107.03 3.81 26.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.199 -173.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.609 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 60.8 mt -67.78 -39.11 16.91 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 52.5 Cg_exo -59.62 -41.5 55.64 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 121.711 1.607 . . . . 0.0 111.198 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 35.8 mmt -71.98 -42.39 66.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.202 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 78.2 mt -59.19 -48.71 80.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.16 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -63.72 -32.91 74.56 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.873 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 97.9 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 . . . . . . . . . . . . . 93.4 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 . 009 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 . 009 nuclear nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 19.1 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 55.6 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 . . . . . . . . . . . . . 88.3 m-20 -56.49 -39.5 73.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.215 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.9 mt -73.89 -41.52 62.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.204 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.59 -32.54 71.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.222 -178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -89.94 2.83 54.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.224 -177.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 69.8 m -85.84 166.28 16.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.178 175.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.84 -33.43 75.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 39.4 t-105 -54.26 -44.71 72.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.217 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -63.34 -42.76 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.23 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -64.04 -34.36 77.84 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-O 120.82 0.343 . . . . 0.0 111.207 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -68.23 -49.53 60.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.192 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 43.9 p -135.16 81.26 45.0 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.182 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -66.68 -33.4 35.43 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 121.708 1.605 . . . . 0.0 111.186 -169.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -74.46 -53.61 9.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.186 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -61.8 -43.39 98.94 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.235 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -65.0 -41.66 95.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.233 178.49 . . . . . . . . 1 1 . 1 . 009 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 116.178 -0.464 . . . . 0.0 112.157 179.164 . . . . . . . . 1 1 . 1 . 009 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 . 009 nuclear nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 70.5 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 . 009 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 91.6 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 . 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 . . . . . . . . . . . . . 5.6 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 40.1 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 . . . . . . . . . . . . . 94.8 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 . 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 . . . . . . . . . . . . . 96.7 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 . 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 . . . . . . . . . . . . . 41.8 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 . . . . . 0.485 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 . . . . . . . . . . . . . 51.6 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 . 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 . . . . . 0.431 ' HE1' ' HA ' ' A' ' 98' ' ' ALA . 25.1 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 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 101' ' ' ASN . 95.6 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 . 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 . . . . . . . . . . . . . 94.5 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 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 88.6 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 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.5 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 . . . . . . . . . . . . . 41.8 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 . 010 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 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 58.9 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 . . . . . . . . . . . . . 88.4 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 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.505 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 . 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 . . . . . . . . . . . . . 66.4 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 . . . . . . . . . . . . . 82.3 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 . . . . . . . . . . . . . 63.6 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 . . . . . . . . . . . . . 89.4 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 . . . . . . . . . . . . . 15.1 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 . . . . . . . . . . . . . 99.4 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 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 43.1 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 . 010 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 . 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 . . . . . . . . . . . . . 77.0 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 . 46.3 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 . . . . . . . . . . . . . 85.0 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 . . . . . . . . . . . . . 27.6 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 . 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 . . . . . 0.417 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 . 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 . . . . . 0.417 ' 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 . 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 . . . . . . . . . . . . . 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 . 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 . . . . . . . . . . . . . 52.3 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 . . . . . . . . . . . . . 71.2 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 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 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 . . . . . . . . . . . . . 45.6 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 . 010 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 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 99.1 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 . . . . . . . . . . . . . 70.1 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 . 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 . . . . . . . . . . . . . 90.8 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 . 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 . . . . . . . . . . . . . 33.0 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 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.5 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 . . . . . . . . . . . . . 99.6 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 . . . . . . . . . . . . . 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 . 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 . . . . . 0.442 HG21 ' HB3' ' A' ' 118' ' ' LEU . 69.9 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 . . . . . . . . . . . . . 73.8 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 . 010 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 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 57.7 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 . 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 . . . . . . . . . . . . . 7.2 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 . 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 . . . . . . . . . . . . . 83.6 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 . . . . . . . . . . . . . 84.6 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 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 87.6 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 . . . . . 0.431 ' 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 . 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 . . . . . 0.485 HG21 HG12 ' A' ' 3' ' ' ILE . 96.4 mt -56.41 -46.28 81.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.19 177.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.482 ' HA ' HD21 ' A' ' 7' ' ' LEU . 13.7 t-20 -59.39 -44.88 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.215 175.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 63.3 tpp -57.88 -32.77 68.01 Favored 'General case' 0 C--N 1.275 -2.645 0 C-N-CA 125.197 1.399 . . . . 0.0 111.15 -174.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 30.6 m -108.7 1.47 9.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -72.07 -44.22 63.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 174.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -100.31 -56.48 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.214 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 99.4 mmm -71.59 133.47 45.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.195 175.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -93.77 -151.73 28.44 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 175.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -50.41 -36.49 33.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.766 0.317 . . . . 0.0 111.209 178.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 88.0 m -56.22 -39.16 72.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.151 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -84.42 -30.87 26.39 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.7 t -62.98 -31.78 53.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.834 0.349 . . . . 0.0 111.178 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.31 -45.26 80.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.215 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -80.89 -34.07 33.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.184 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -62.92 -29.92 71.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.207 177.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 82.4 m -62.24 -27.04 68.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.197 176.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -68.72 -19.87 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.161 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.0 m -111.3 0.53 16.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.212 -173.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.585 ' N ' ' CD ' ' A' ' 119' ' ' PRO . 42.2 mt -66.82 -40.84 33.57 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 118' ' ' LEU . 61.9 Cg_exo -58.61 -43.28 46.34 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 121.655 1.57 . . . . 0.0 111.212 -178.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 37.1 mmt -67.24 -42.7 83.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.171 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.42 -46.93 88.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.174 179.624 . . . . . . . . 1 1 . 1 . 010 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 119.671 -0.812 . . . . 0.0 111.873 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 98.1 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 . . . . . . . . . . . . . 82.2 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 . . . . . . . . . . . . . 19.6 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 . . . . . . . . . . . . . 77.1 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 . 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 . . . . . . . . . . . . . 53.3 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 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -65.34 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.22 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 74.7 mt -67.32 -33.98 76.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.225 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -70.72 -14.25 62.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.207 -175.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -95.04 3.01 55.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.162 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 56.8 p -75.04 160.44 30.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -67.87 -29.53 68.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.225 177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TRP . . . . . . . . . . . . . 19.7 t-105 -61.95 -45.9 91.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 176.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -64.62 -42.6 95.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.213 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -56.89 -44.01 81.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.196 173.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -69.72 -50.08 47.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.229 -174.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 27.8 m -142.72 79.25 15.17 Favored Pre-proline 0 C--N 1.293 -1.887 0 C-N-CA 123.346 0.658 . . . . 0.0 111.251 -176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -67.96 -19.22 46.26 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 121.736 1.624 . . . . 0.0 111.235 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.05 -28.06 69.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.231 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -99.84 -39.45 8.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.209 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -64.48 -35.06 79.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 -169.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.84 -42.81 85.18 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.157 178.147 . . . . . . . . 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 . . . . . . . . . . . . . 88.2 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 . 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 . . . . . . . . . . . . . 17.1 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 . . . . . . . . . . . . . 35.6 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 . . . . . . . . . . . . . 89.5 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 . 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 . . . . . . . . . . . . . 96.0 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 . . . . . . . . . . . . . 31.5 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 . 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_