data_2l12_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 2l12 _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 ' 3' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.6 m -124.77 142.51 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.651 0.78 . . . . 0.0 110.614 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -135.41 163.21 30.55 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.285 1.034 . . . . 0.0 109.173 176.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.03 105.72 3.43 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.4 0.68 . . . . 0.0 109.376 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG11 ' CZ3' ' A' ' 26' ' ' TRP . 1.6 m -87.56 154.13 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.906 -176.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -82.08 -79.99 0.17 Allowed 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.0 m -160.21 -174.04 4.33 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.517 1.127 . . . . 0.0 108.804 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.549 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.4 mm -80.88 134.72 26.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 172.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.73 4.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.902 0.881 . . . . 0.0 109.571 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -133.43 153.72 51.37 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.979 0.911 . . . . 0.0 109.306 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -135.73 135.32 39.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.7 ptm85 -162.47 173.36 14.15 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.606 0.762 . . . . 0.0 110.106 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.425 HG21 HG23 ' A' ' 20' ' ' VAL . 14.4 t -119.34 119.9 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 175.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -118.93 110.75 17.52 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.985 0.914 . . . . 0.0 110.059 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp 60.55 31.5 20.26 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 124.287 1.035 . . . . 0.0 111.832 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.48 10.04 62.42 Favored Glycine 0 C--N 1.352 1.467 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.377 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.591 ' HZ3' ' HB2' ' A' ' 40' ' ' GLU . 30.9 mmmt -124.64 111.82 16.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.956 0.903 . . . . 0.0 109.98 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.425 HG23 HG21 ' A' ' 15' ' ' VAL . 38.4 t -70.62 108.15 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.699 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 18.9 pt-20 -107.57 151.26 25.85 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.796 0.808 . . . . 0.0 110.696 -176.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.549 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -130.71 125.88 35.06 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.33 -173.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.8 tp -73.89 83.2 1.69 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.1 t -68.59 111.08 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -76.74 117.56 18.48 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.485 ' CZ3' HG11 ' A' ' 7' ' ' VAL . 26.6 m95 -90.46 121.1 32.12 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 176.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -70.43 -37.75 74.45 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -161.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.04 -10.99 84.21 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 116.523 -0.308 . . . . 0.0 113.268 177.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -108.43 148.99 38.75 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.618 1.167 . . . . 0.0 109.165 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.9 159.65 50.68 Favored 'Trans proline' 0 CA--C 1.559 1.742 0 C-N-CA 122.092 1.861 . . . . 0.0 111.141 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.93 -16.22 48.15 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.966 2.444 . . . . 0.0 113.449 -176.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.488 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -72.25 -31.22 65.61 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.169 0.588 . . . . 0.0 111.694 173.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -88.65 9.74 23.12 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.526 0.73 . . . . 0.0 111.802 177.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.7 m -75.33 132.39 40.94 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.7 p -121.4 168.25 11.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.621 0.768 . . . . 0.0 111.059 -172.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -97.39 95.18 7.5 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.253 0.621 . . . . 0.0 110.997 -175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -96.96 122.88 55.31 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 123.645 0.778 . . . . 0.0 109.327 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.699 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 59.4 Cg_endo -69.03 171.24 14.0 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.085 1.857 . . . . 0.0 112.291 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -27.17 44.66 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.143 0.977 . . . . 0.0 111.774 174.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.591 ' HB2' ' HZ3' ' A' ' 19' ' ' LYS . 32.6 tt0 -57.87 -34.9 70.25 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.47 1.508 . . . . 0.0 111.293 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -98.64 -19.76 17.36 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.187 0.995 . . . . 0.0 111.511 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.641 HG21 HD21 ' A' ' 47' ' ' LEU . 51.2 mm -71.35 114.42 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 123.024 0.53 . . . . 0.0 109.974 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.1 mt -83.65 -50.49 8.14 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.552 0.691 . . . . 0.0 110.14 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -93.39 133.14 28.83 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.525 -166.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.26 -38.62 8.63 Favored 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.625 2.217 . . . . 0.0 112.201 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 47.6 mtm180 -69.82 -17.18 63.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.316 1.046 . . . . 0.0 111.119 -176.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.641 HD21 HG21 ' A' ' 42' ' ' ILE . 19.6 tp -59.21 -48.73 80.53 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 123.901 0.88 . . . . 0.0 111.142 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 80.7 t -84.46 -38.73 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.509 0.724 . . . . 0.0 110.675 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.492 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 57.7 mtt -64.94 -32.12 73.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.348 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.94 82.31 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.88 0.472 . . . . 0.0 109.862 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -58.84 -38.19 78.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.495 1.118 . . . . 0.0 111.718 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -176.194 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.457 ' O ' HG21 ' A' ' 7' ' ' VAL . 4.8 pm0 . . . . . 0 CA--C 1.549 0.933 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 23.8 m -146.99 153.25 39.84 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.105 0.478 . . . . 0.0 111.903 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.07 148.6 42.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.863 1.265 . . . . 0.0 108.858 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 N--CA 1.484 1.27 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 170.594 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.494 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.6 mp0 . . . . . 0 CA--C 1.543 0.689 0 CA-C-O 120.763 0.316 . . . . 0.0 111.544 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.15 126.84 52.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 123.775 0.83 . . . . 0.0 109.362 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.494 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 38.7 m-85 -131.0 152.74 49.99 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.297 0.639 . . . . 0.0 110.583 -177.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.15 107.72 1.65 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.311 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 20.3 m -90.85 155.88 3.05 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.314 1.046 . . . . 0.0 110.742 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -83.22 -74.01 0.38 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 161.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.6 m -161.4 -177.57 6.07 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.325 1.05 . . . . 0.0 109.628 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.6 mm -76.33 114.49 16.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 172.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.0 -51.48 38.85 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 123.343 0.657 . . . . 0.0 109.369 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -139.28 155.82 47.48 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.792 0.837 . . . . 0.0 110.355 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -146.12 134.33 21.69 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.093 0.957 . . . . 0.0 109.071 -175.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.42 HH21 ' HB2' ' A' ' 16' ' ' ARG . 7.2 ptm180 -163.21 -174.55 3.87 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.708 1.203 . . . . 0.0 109.465 -173.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -136.66 139.73 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.541 0.736 . . . . 0.0 109.18 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.42 ' HB2' HH21 ' A' ' 14' ' ' ARG . 22.3 tpt180 -141.72 132.24 25.34 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt 59.49 26.12 15.02 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.599 1.16 . . . . 0.0 112.102 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.05 23.71 73.71 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.414 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -125.68 120.87 31.87 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.641 0.776 . . . . 0.0 109.288 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 28.1 t -73.88 112.96 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.293 0.637 . . . . 0.0 110.348 -174.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -96.86 147.87 23.51 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.493 0.717 . . . . 0.0 110.604 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.416 ' HB2' ' HE1' ' A' ' 41' ' ' HIS . 90.9 m-85 -132.4 112.35 12.09 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.989 0.916 . . . . 0.0 109.735 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.98 101.0 3.1 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 164.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.779 HG23 ' HE2' ' A' ' 41' ' ' HIS . 88.3 t -93.36 123.61 45.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-O 121.054 0.454 . . . . 0.0 110.321 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -83.98 107.76 16.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.821 172.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.423 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 9.1 m95 -83.19 119.05 24.06 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 174.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -69.17 -28.33 66.32 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.269 0.486 . . . . 0.0 111.816 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.39 -23.18 77.66 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.595 -0.275 . . . . 0.0 113.283 175.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 15.0 m95 -107.97 139.37 20.6 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.211 1.004 . . . . 0.0 109.54 -174.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -62.31 156.36 51.57 Favored 'Trans proline' 0 CA--C 1.563 1.964 0 C-N-CA 122.469 2.113 . . . . 0.0 111.86 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.79 -26.48 17.83 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.92 3.08 . . . . 0.0 115.427 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -67.44 -14.29 62.8 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -111.27 18.55 19.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.984 0.914 . . . . 0.0 111.692 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 p -68.69 123.18 20.2 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.0 p -121.28 167.15 13.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.272 0.629 . . . . 0.0 111.588 -172.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -111.16 121.73 46.06 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.204 1.002 . . . . 0.0 109.394 -173.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -129.54 146.44 61.08 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -75.76 174.79 12.22 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.127 1.885 . . . . 0.0 112.701 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 10.8 pt-20 -49.58 -28.28 5.49 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 126.308 1.843 . . . . 0.0 114.613 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.76 -33.7 61.59 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.881 1.272 . . . . 0.0 112.44 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.779 ' HE2' HG23 ' A' ' 24' ' ' VAL . 3.4 p-80 -81.67 -18.83 43.17 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -168.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.7 mm -72.87 113.57 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.95 0.5 . . . . 0.0 109.681 -176.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -88.38 -33.56 17.88 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.98 0.419 . . . . 0.0 110.634 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.442 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 13.6 t70 -119.69 130.64 24.74 Favored Pre-proline 0 N--CA 1.48 1.043 0 C-N-CA 123.822 0.849 . . . . 0.0 110.709 -174.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.95 -36.08 40.48 Favored 'Trans proline' 0 C--N 1.381 2.271 0 C-N-CA 123.066 2.511 . . . . 0.0 113.008 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.401 ' HB2' HE21 ' B' ' 5' ' ' GLN . 95.0 mtt180 -65.37 -23.55 67.01 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.06 0.544 . . . . 0.0 111.05 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.7 -52.37 65.21 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.652 0.781 . . . . 0.0 111.202 173.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.7 t -71.83 -51.86 29.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.846 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 23.1 mmt -62.09 -28.46 69.63 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.409 -1.269 . . . . 0.0 112.667 -172.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.87 -44.79 92.01 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 121.289 0.566 . . . . 0.0 111.002 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -72.11 -36.85 69.55 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.324 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 . . . . . 0 N--CA 1.475 0.801 0 C-N-CA 122.441 0.296 . . . . 0.0 111.185 -177.985 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.442 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 26.6 mp0 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -65.47 145.04 56.62 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 123.695 0.798 . . . . 0.0 111.59 -172.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.453 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -137.72 116.69 12.43 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.143 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 41.6 mtm180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.493 175.272 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 CA--C 1.55 0.961 0 CA-C-O 120.437 0.16 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' B' ' 8' ' ' ARG . 33.4 m -132.07 142.42 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 123.683 0.793 . . . . 0.0 109.821 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -135.53 160.29 38.93 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.044 0.938 . . . . 0.0 110.218 -177.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.73 114.81 4.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.528 0.731 . . . . 0.0 109.927 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.6 m -80.02 153.0 4.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.187 0.518 . . . . 0.0 110.698 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.526 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 37.3 tt0 -94.19 -62.33 1.36 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.58 -172.79 2.0 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.528 1.531 . . . . 0.0 108.559 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 mm -91.92 139.45 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 164.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -50.28 4.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.457 0.703 . . . . 0.0 109.916 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -137.55 171.26 14.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.385 0.674 . . . . 0.0 110.603 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.72 134.2 15.39 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -173.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -155.67 -178.0 6.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.987 0.915 . . . . 0.0 110.047 -174.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.97 139.57 33.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 108.805 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -149.83 108.97 3.92 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.134 0.973 . . . . 0.0 108.844 -170.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm 59.99 32.36 21.07 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.243 1.017 . . . . 0.0 111.242 -177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.66 -17.83 56.77 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 115.27 -0.877 . . . . 0.0 113.55 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.88 111.95 21.98 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.043 0.537 . . . . 0.0 110.481 -177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.09 110.48 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 177.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -103.61 148.47 25.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.456 1.102 . . . . 0.0 109.833 -172.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -128.77 123.75 33.73 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -71.7 83.12 0.87 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -65.74 105.93 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.6 112.78 14.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 37.0 m95 -83.89 147.48 27.49 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 177.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 87.9 tttt -62.77 -53.86 47.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.714 0.806 . . . . 0.0 112.33 -166.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.57 1.12 83.67 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 54.5 m95 -116.86 134.99 22.9 Favored Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 123.218 0.607 . . . . 0.0 110.812 -171.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.99 167.68 25.35 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 123.276 2.651 . . . . 0.0 112.712 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -51.45 -28.63 28.49 Favored 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 123.855 3.037 . . . . 0.0 115.34 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -72.73 -28.4 62.63 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.494 0.318 . . . . 0.0 111.318 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -102.86 11.27 37.71 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.49 0.716 . . . . 0.0 111.069 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.436 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.7 m -86.97 137.34 32.44 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 167.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.491 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 25.3 p -110.94 139.22 46.47 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.366 0.666 . . . . 0.0 110.918 -169.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.81 76.32 5.3 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.726 0.811 . . . . 0.0 110.031 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.491 ' HG2' ' HG1' ' A' ' 35' ' ' THR . 75.9 mm-40 -91.48 122.37 66.02 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 123.55 0.74 . . . . 0.0 109.218 -178.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.76 174.98 7.82 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.732 2.288 . . . . 0.0 112.95 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.69 -15.58 30.43 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.77 1.228 . . . . 0.0 112.268 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -55.35 -42.97 74.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.734 1.214 . . . . 0.0 110.922 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -105.13 -9.56 17.7 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.765 -171.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.577 HG22 HD22 ' A' ' 47' ' ' LEU . 50.4 mm -71.92 112.24 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.549 HD13 ' HB ' ' B' ' 6' ' ' THR . 35.6 mt -71.07 -21.73 62.2 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -172.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -143.55 128.09 9.53 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 122.825 0.45 . . . . 0.0 110.198 -169.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.48 -35.11 98.89 Favored 'Trans proline' 0 C--N 1.38 2.19 0 C-N-CA 122.79 2.327 . . . . 0.0 112.91 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -67.57 -20.29 65.37 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.693 0.397 . . . . 0.0 111.839 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.577 HD22 HG22 ' A' ' 42' ' ' ILE . 24.0 tp -57.39 -42.78 82.89 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.054 0.388 . . . . 0.0 110.423 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 48.8 t -87.81 -46.74 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.663 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtt -63.7 -46.93 83.24 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.764 0.825 . . . . 0.0 112.53 -172.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.58 -33.44 75.61 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 123.642 0.589 . . . . 0.0 110.683 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.36 -48.47 81.62 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.507 0.504 . . . . 0.0 110.445 169.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' VAL . 46.2 mt-10 . . . . . 0 N--CA 1.485 1.292 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -173.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.517 ' HG3' ' HB2' ' A' ' 47' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 121.467 0.651 . . . . 0.0 111.401 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.549 ' HB ' HD13 ' A' ' 43' ' ' LEU . 19.0 m -148.86 162.08 40.56 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.899 1.28 . . . . 0.0 108.629 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.74 150.52 47.65 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.56 ' HA ' HG12 ' A' ' 4' ' ' VAL . 12.0 mmm-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 121.07 0.462 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.1 m -99.82 152.3 4.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.386 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -131.19 143.94 50.97 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.859 0.463 . . . . 0.0 110.172 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.19 110.21 4.46 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.175 175.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.468 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 18.5 m -97.13 154.56 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.768 0.427 . . . . 0.0 111.295 -172.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.434 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 36.1 tt0 -81.08 -69.83 0.58 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 170.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.9 m -166.21 -177.6 4.2 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.836 1.254 . . . . 0.0 109.487 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.437 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.9 mm -76.61 142.46 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 167.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.2 -46.69 4.36 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -143.04 165.07 28.38 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.489 1.116 . . . . 0.0 109.928 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -153.69 128.67 9.58 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.783 0.833 . . . . 0.0 108.775 -169.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -155.85 -174.3 4.9 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.218 1.007 . . . . 0.0 109.467 -179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -135.59 129.81 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.2 ttp85 -133.74 119.39 19.23 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.151 0.98 . . . . 0.0 109.157 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HB2' ' HZ3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER 62.86 27.76 16.13 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.403 1.081 . . . . 0.0 111.52 177.023 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.16 10.87 79.65 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.442 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 111.99 23.23 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.544 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 70.6 t -70.93 109.88 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -96.62 145.17 25.98 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.432 0.634 . . . . 0.0 110.095 -171.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.437 ' HB3' HD12 ' A' ' 10' ' ' ILE . 96.5 m-85 -127.21 111.49 14.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.589 -1.187 . . . . 0.0 107.869 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 tp -66.61 81.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 167.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.521 HG22 ' HE2' ' A' ' 41' ' ' HIS . 95.6 t -77.37 116.15 20.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -78.05 111.2 13.71 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 170.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.713 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 5.6 m95 -85.3 140.53 30.75 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 4.3 tppp? -58.0 -57.36 13.14 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -168.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.44 1.39 88.87 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.924 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.713 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 61.8 m95 -115.15 128.2 26.15 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.421 0.689 . . . . 0.0 109.918 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.72 175.67 6.92 Favored 'Trans proline' 0 CA--C 1.572 2.416 0 C-N-CA 123.32 2.68 . . . . 0.0 112.905 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -65.11 -13.36 39.37 Favored 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.607 2.204 . . . . 0.0 114.614 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -79.99 -8.72 59.5 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 122.187 -0.321 . . . . 0.0 111.423 173.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -114.9 -8.74 12.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.982 0.913 . . . . 0.0 111.778 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.6 p -64.25 117.02 6.59 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 169.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.5 p -122.87 148.2 45.7 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.958 0.409 . . . . 0.0 111.745 -169.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.74 87.46 4.64 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.646 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -102.51 133.74 20.34 Favored Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.25 166.57 26.5 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.236 2.624 . . . . 0.0 114.135 -171.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 12.4 pt-20 -49.58 -29.82 7.65 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.469 1.907 . . . . 0.0 114.785 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.24 -45.49 91.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.723 0.809 . . . . 0.0 111.55 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.521 ' HE2' HG22 ' A' ' 24' ' ' VAL . 2.1 p-80 -62.74 -17.22 60.51 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -172.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.69 111.69 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.315 0.646 . . . . 0.0 109.825 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.542 HD21 ' HG2' ' B' ' 8' ' ' ARG . 53.8 mt -81.8 -15.25 54.81 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 120.908 0.385 . . . . 0.0 111.453 -176.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -144.87 119.7 5.8 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 123.431 0.692 . . . . 0.0 109.662 -164.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.22 -34.19 79.19 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 122.584 2.189 . . . . 0.0 112.269 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.493 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.9 mtt85 -65.77 -20.11 66.14 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.174 0.99 . . . . 0.0 110.774 -173.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.1 tp -59.47 -52.03 67.34 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.444 1.098 . . . . 0.0 111.272 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 39.4 t -78.85 -35.0 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.299 0.639 . . . . 0.0 109.915 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.493 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.6 mmt -68.5 -28.83 67.36 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.526 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.9 -30.56 56.23 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 122.882 0.473 . . . . 0.0 111.328 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -61.03 -50.53 72.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.138 0.575 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 . . . . . 0 N--CA 1.476 0.84 0 C-N-CA 123.809 0.844 . . . . 0.0 111.53 -179.156 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.461 HE21 ' HB2' ' A' ' 46' ' ' ARG . 19.2 mp0 . . . . . 0 C--O 1.239 0.512 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -139.93 162.31 35.48 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 124.338 1.055 . . . . 0.0 109.813 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -148.78 141.66 24.71 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.831 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.542 ' HG2' HD21 ' A' ' 43' ' ' LEU . 19.5 mmt85 . . . . . 0 N--CA 1.485 1.3 0 C-N-CA 123.906 0.883 . . . . 0.0 111.849 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.447 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 85.5 mt-30 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.5 m -112.0 123.85 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.771 0.828 . . . . 0.0 109.152 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.447 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 21.8 m-85 -124.79 162.78 23.54 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.641 0.776 . . . . 0.0 109.588 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.87 112.78 4.47 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.334 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.509 HG22 HD12 ' A' ' 47' ' ' LEU . 32.7 m -74.55 154.34 6.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.283 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.7 tp10 -89.24 -64.96 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 166.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.2 m -165.01 175.2 9.68 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.827 1.251 . . . . 0.0 108.685 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.501 HD11 ' HG ' ' A' ' 47' ' ' LEU . 41.3 mm -78.95 117.71 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 162.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -72.46 -56.49 5.33 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.1 mttm -132.76 161.74 33.29 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.411 0.684 . . . . 0.0 110.956 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -146.54 136.55 23.46 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.414 1.085 . . . . 0.0 108.4 -176.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -159.79 177.55 10.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.045 0.538 . . . . 0.0 110.303 -173.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.448 HG21 HG23 ' A' ' 20' ' ' VAL . 22.2 t -130.15 118.27 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 169.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.497 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 13.8 tpt85 -146.12 137.9 24.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.354 1.062 . . . . 0.0 108.895 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mtmt 64.99 25.05 12.68 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.278 1.031 . . . . 0.0 111.095 -178.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.05 4.83 84.14 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.876 -0.602 . . . . 0.0 113.411 -175.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -116.49 130.82 56.96 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.963 0.905 . . . . 0.0 110.312 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.448 HG23 HG21 ' A' ' 15' ' ' VAL . 46.3 t -79.23 108.29 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 39.0 mt-10 -101.16 147.26 26.45 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.151 0.581 . . . . 0.0 110.356 -171.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -129.04 123.13 31.53 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.058 0.943 . . . . 0.0 108.902 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.6 tp -76.12 88.07 3.02 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 167.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.504 HG21 ' HE2' ' A' ' 41' ' ' HIS . 91.9 t -78.13 111.3 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.082 0.553 . . . . 0.0 110.116 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.562 ' HZ1' ' HA ' ' A' ' 31' ' ' PRO . 4.9 tmtm? -83.18 132.4 35.07 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -106.36 135.2 48.26 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 19.9 ttmm -56.27 -59.97 4.18 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -165.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.27 17.98 25.69 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.437 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -122.92 134.7 25.2 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.211 1.004 . . . . 0.0 109.542 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -56.27 155.85 23.24 Favored 'Trans proline' 0 CA--C 1.567 2.125 0 C-N-CA 123.464 2.776 . . . . 0.0 113.378 -177.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.562 ' HA ' ' HZ1' ' A' ' 25' ' ' LYS . 87.5 Cg_exo -47.34 -38.27 26.25 Favored 'Trans proline' 0 C--N 1.383 2.376 0 C-N-CA 124.357 3.371 . . . . 0.0 116.029 -176.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -81.8 -9.05 59.73 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -91.95 10.25 29.67 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.71 0.804 . . . . 0.0 111.53 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.8 m -71.2 137.9 49.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 169.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 p -119.78 147.52 44.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.863 0.465 . . . . 0.0 111.43 -171.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -94.43 119.59 33.38 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.962 0.905 . . . . 0.0 110.213 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -138.73 147.53 54.87 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 123.204 0.602 . . . . 0.0 109.631 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 16.0 Cg_exo -65.31 177.73 2.44 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 123.251 2.634 . . . . 0.0 113.12 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.54 -15.88 59.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.794 0.838 . . . . 0.0 112.587 -178.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.82 -23.76 66.75 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.847 1.259 . . . . 0.0 112.766 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' B' ' 7' ' ' ALA . 1.6 p-80 -89.37 -7.26 55.61 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.1 mm -71.08 112.93 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.559 0.744 . . . . 0.0 110.423 -175.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.6 mt -90.28 -10.82 42.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.013 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -150.69 131.01 6.97 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.637 -174.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -61.17 -33.0 91.47 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.174 2.583 . . . . 0.0 113.049 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.585 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 39.0 mmt180 -65.32 -15.73 62.84 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.381 0.672 . . . . 0.0 112.092 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.58 ' HB2' ' HB3' ' B' ' 5' ' ' GLN . 14.1 tp -64.57 -48.25 75.69 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.043 0.537 . . . . 0.0 110.737 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.32 -32.71 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.301 0.64 . . . . 0.0 110.251 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.585 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 52.7 mtt -61.57 -48.96 78.58 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.189 0.995 . . . . 0.0 111.396 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.74 -28.46 69.9 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.392 0.677 . . . . 0.0 111.475 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.87 -55.62 16.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.701 0.401 . . . . 0.0 110.984 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 . . . . . 0 N--CA 1.479 0.988 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.714 -170.798 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.58 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.8 mp0 . . . . . 0 CA--C 1.541 0.626 0 CA-C-O 121.545 0.688 . . . . 0.0 110.408 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 p -82.42 172.37 13.13 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 -170.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.554 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -162.8 133.6 4.79 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.859 -169.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? . . . . . 0 N--CA 1.494 1.764 0 C-N-CA 122.834 0.454 . . . . 0.0 110.075 175.96 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.565 0.221 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -97.92 153.38 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.987 0.915 . . . . 0.0 111.351 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.508 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 54.6 m-85 -137.46 156.77 47.78 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.568 1.147 . . . . 0.0 108.152 171.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.467 ' HB1' ' HE2' ' A' ' 27' ' ' LYS . . . -68.81 125.67 27.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.35 0.66 . . . . 0.0 110.522 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.14 154.06 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.377 0.671 . . . . 0.0 110.25 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 12.7 tp10 -83.82 -69.52 0.63 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.4 m -158.86 -161.14 0.93 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.977 1.311 . . . . 0.0 108.16 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.483 HG22 ' HB3' ' A' ' 22' ' ' TYR . 48.1 mm -90.71 121.7 41.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.025 0.53 . . . . 0.0 109.98 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -77.41 -55.03 5.73 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.097 0.959 . . . . 0.0 109.836 -179.572 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -135.51 171.64 14.15 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.214 0.606 . . . . 0.0 110.552 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -155.81 143.31 19.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.023 0.529 . . . . 0.0 110.587 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -165.56 163.1 19.41 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.373 1.069 . . . . 0.0 108.556 175.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.557 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 14.0 p -101.31 137.82 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 168.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -153.39 127.99 9.37 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.292 0.637 . . . . 0.0 109.552 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.7 tptt 65.52 26.26 11.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.748 1.219 . . . . 0.0 111.077 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.82 3.71 90.44 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.524 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -119.27 119.16 33.24 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.759 0.824 . . . . 0.0 109.598 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.557 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 34.6 t -71.01 107.49 2.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 176.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.542 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 9.1 pt-20 -100.16 137.92 37.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.993 0.917 . . . . 0.0 109.72 -177.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.483 ' HB3' HG22 ' A' ' 10' ' ' ILE . 42.4 m-85 -116.75 123.19 46.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.115 -1.402 . . . . 0.0 107.838 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 tp -67.25 88.18 0.18 Allowed 'General case' 0 C--N 1.347 0.475 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 165.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.86 126.37 31.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 28.1 tptp -77.49 99.86 5.83 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.508 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 62.0 m95 -75.08 105.02 5.89 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 173.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 65.5 pttt -70.31 -20.01 63.04 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -162.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.25 -13.06 79.85 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 123.002 0.189 . . . . 0.0 112.653 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -125.17 152.65 71.13 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 109.735 -170.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.03 165.1 33.49 Favored 'Trans proline' 0 CA--C 1.567 2.127 0 C-N-CA 122.455 2.103 . . . . 0.0 111.603 172.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.79 -20.64 69.92 Favored 'Trans proline' 0 C--N 1.391 2.804 0 C-N-CA 123.214 2.609 . . . . 0.0 113.793 -174.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -80.2 -29.16 38.57 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.391 0.277 . . . . 0.0 111.6 176.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -87.69 -6.49 58.2 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.044 0.538 . . . . 0.0 110.745 173.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.1 m -78.55 157.91 28.67 Favored 'General case' 0 C--N 1.353 0.754 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -139.37 155.18 47.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 120.612 0.244 . . . . 0.0 111.601 -164.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -87.27 92.25 9.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.2 1.0 . . . . 0.0 111.129 -175.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' B' ' 8' ' ' ARG . 5.3 mp0 -104.78 121.49 46.66 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 124.243 1.017 . . . . 0.0 109.976 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.542 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 35.5 Cg_exo -61.44 174.42 2.1 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.933 2.422 . . . . 0.0 114.121 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.33 -13.81 61.11 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.546 -175.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -25.58 53.15 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.233 0.213 . . . . 0.0 111.377 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -80.04 -25.07 40.3 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.533 0.733 . . . . 0.0 111.4 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.635 HG22 HD22 ' A' ' 47' ' ' LEU . 50.4 mm -68.37 127.82 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.045 0.938 . . . . 0.0 110.46 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' B' ' 6' ' ' THR . 56.9 mt -77.15 -64.09 1.22 Allowed 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.106 0.479 . . . . 0.0 110.956 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -100.65 133.5 21.18 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.498 -172.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -59.56 -30.82 93.33 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 123.219 2.613 . . . . 0.0 113.343 -175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.443 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 67.7 mtp180 -69.48 -16.04 63.38 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.58 0.752 . . . . 0.0 112.045 -176.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.635 HD22 HG22 ' A' ' 42' ' ' ILE . 20.2 tp -59.93 -43.57 94.87 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 120.968 0.413 . . . . 0.0 110.642 172.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 77.3 t -82.74 -48.89 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.417 175.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.443 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -65.66 -31.69 72.84 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.645 1.178 . . . . 0.0 113.303 -169.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.25 -37.46 69.12 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.829 0.347 . . . . 0.0 110.884 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -66.13 -39.16 89.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.507 0.723 . . . . 0.0 110.344 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 . . . . . 0 N--CA 1.474 0.743 0 C-N-CA 123.683 0.793 . . . . 0.0 111.836 178.285 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.499 ' HB3' HD11 ' A' ' 47' ' ' LEU . 84.6 mm-40 . . . . . 0 C--O 1.242 0.66 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.553 ' HB ' HD11 ' A' ' 43' ' ' LEU . 30.9 m -150.75 157.72 43.29 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 124.003 0.921 . . . . 0.0 109.03 -173.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.81 161.95 36.74 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.953 0.901 . . . . 0.0 109.702 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 37' ' ' GLU . 5.2 mpt_? . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 . . . . . 0 CA--C 1.542 0.669 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.554 HG13 ' HG2' ' B' ' 8' ' ' ARG . 31.1 m -101.89 137.76 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.583 0.753 . . . . 0.0 109.788 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -134.21 159.94 39.39 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 124.062 0.945 . . . . 0.0 109.29 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.59 144.3 32.49 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.951 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.408 HG23 HD11 ' A' ' 47' ' ' LEU . 22.7 m -91.09 154.81 3.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.099 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.5 tt0 -82.88 -57.89 3.11 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 160.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -163.52 177.65 8.65 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.917 1.287 . . . . 0.0 109.351 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.1 mm -81.2 114.94 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 162.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -54.84 18.3 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.75 0.82 . . . . 0.0 109.453 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -143.59 169.82 17.0 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.8 0.84 . . . . 0.0 111.092 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -149.23 135.41 19.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.53 1.132 . . . . 0.0 108.888 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -160.74 175.51 12.53 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.556 0.743 . . . . 0.0 109.16 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -117.94 114.84 46.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 CA-C-O 121.511 0.672 . . . . 0.0 109.573 170.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -105.9 97.67 7.46 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 124.878 1.271 . . . . 0.0 109.678 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 62.16 41.88 10.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 172.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.13 -15.11 63.67 Favored Glycine 0 N--CA 1.472 1.097 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.301 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm -88.4 109.93 20.41 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.435 0.694 . . . . 0.0 109.2 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.29 106.14 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.585 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 77.5 mt-10 -114.09 150.19 34.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.718 -168.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -122.6 116.7 24.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.438 -1.71 . . . . 0.0 108.2 -176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.0 tp -69.22 104.27 2.16 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.415 HG21 ' NE2' ' A' ' 41' ' ' HIS . 14.8 t -94.08 108.68 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -170.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -76.89 120.73 22.43 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.1 m95 -93.24 153.26 18.7 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.12 0.568 . . . . 0.0 110.433 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -70.98 -9.27 57.69 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -163.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -149.47 24.17 1.21 Allowed Glycine 0 N--CA 1.474 1.221 0 CA-C-N 117.937 0.335 . . . . 0.0 112.342 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 51.0 m95 -123.4 136.9 27.65 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 124.131 0.972 . . . . 0.0 108.484 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -59.13 159.76 21.12 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 122.941 2.427 . . . . 0.0 112.959 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -53.39 -30.2 51.78 Favored 'Trans proline' 0 C--N 1.382 2.297 0 C-N-CA 123.393 2.729 . . . . 0.0 114.278 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.6 ' HB2' ' HZ1' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -79.1 -15.02 58.76 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 178.491 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -99.85 17.24 21.3 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.598 0.759 . . . . 0.0 111.698 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -81.1 141.19 34.54 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.2 p -110.19 130.13 55.6 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -169.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.58 96.46 1.97 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.838 0.455 . . . . 0.0 109.986 170.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -123.47 131.58 24.29 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.155 0.982 . . . . 0.0 109.92 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 84.4 Cg_endo -70.59 170.63 17.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.131 2.554 . . . . 0.0 113.672 -175.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -53.39 -17.11 1.67 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.847 1.259 . . . . 0.0 114.316 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.29 -39.24 89.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.933 0.893 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.455 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 9.3 p-80 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.806 0.442 . . . . 0.0 111.996 -177.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.8 mm -67.85 116.01 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 124.324 1.049 . . . . 0.0 110.515 -175.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.2 mt -99.22 8.55 44.7 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.954 0.502 . . . . 0.0 111.348 -176.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -150.08 118.98 3.7 Favored Pre-proline 0 N--CA 1.483 1.199 0 C-N-CA 123.581 0.753 . . . . 0.0 109.714 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.47 -36.8 52.55 Favored 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 122.954 2.436 . . . . 0.0 112.576 -177.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -65.12 -22.33 66.92 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 125.221 1.408 . . . . 0.0 111.469 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.408 HD11 HG23 ' A' ' 7' ' ' VAL . 16.9 tp -59.56 -52.17 66.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.816 0.846 . . . . 0.0 111.375 174.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.88 -42.23 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.569 0.699 . . . . 0.0 111.02 178.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -74.46 -26.81 60.27 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.649 -171.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.93 -29.05 55.47 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.126 0.571 . . . . 0.0 111.11 175.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -59.44 -45.75 90.7 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.529 0.731 . . . . 0.0 109.953 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 . . . . . 0 N--CA 1.475 0.818 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.581 178.025 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--O 1.237 0.417 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.4 p -76.06 148.39 38.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.268 -176.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.455 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.94 132.3 16.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.824 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.554 ' HG2' HG13 ' A' ' 4' ' ' VAL . 23.4 mtm180 . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.207 0.603 . . . . 0.0 111.074 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.276 0.084 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -85.5 138.62 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.688 0.795 . . . . 0.0 110.756 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -131.12 157.61 42.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.764 0.826 . . . . 0.0 109.771 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.17 107.22 10.6 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 123.578 0.751 . . . . 0.0 109.333 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.91 154.2 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.832 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.546 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.1 tt0 -93.44 -52.94 4.27 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.409 0.683 . . . . 0.0 109.668 177.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -161.93 168.21 23.3 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.67 1.188 . . . . 0.0 109.839 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.447 HD11 HG21 ' A' ' 24' ' ' VAL . 32.4 mm -77.28 115.07 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 162.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.416 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -69.86 -58.61 3.67 Favored 'General case' 0 CA--C 1.556 1.177 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.082 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.416 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.0 mtpp -139.08 171.48 14.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.978 0.911 . . . . 0.0 110.994 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -154.32 133.05 12.2 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.651 1.18 . . . . 0.0 108.569 -171.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -160.23 179.57 8.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.981 0.913 . . . . 0.0 110.074 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 8.9 p -129.81 138.04 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.461 0.704 . . . . 0.0 109.966 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -138.74 100.68 4.13 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.503 1.121 . . . . 0.0 108.904 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 60.59 36.86 19.71 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.127 0.971 . . . . 0.0 111.43 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.58 -10.77 73.52 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.2 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -99.8 108.84 21.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.218 0.607 . . . . 0.0 110.18 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 59.9 t -76.95 112.31 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.608 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -96.27 139.3 32.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.669 0.788 . . . . 0.0 109.835 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.422 ' HB2' ' HE2' ' A' ' 41' ' ' HIS . 41.0 m-85 -118.72 110.18 16.96 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.7 tp -69.84 105.37 2.76 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 167.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.541 HG22 ' HE1' ' A' ' 41' ' ' HIS . 76.2 t -101.05 118.88 48.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -77.39 115.66 17.34 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 171.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 11.1 m95 -90.38 144.44 25.81 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.546 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 30.5 ttmt -64.23 -53.85 42.75 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -166.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.83 1.46 86.28 Favored Glycine 0 CA--C 1.533 1.172 0 N-CA-C 113.798 0.279 . . . . 0.0 113.798 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.6 m95 -114.81 135.8 22.44 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.741 0.816 . . . . 0.0 109.322 -177.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -64.51 160.7 38.41 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 C-N-CA 122.467 2.111 . . . . 0.0 112.038 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.52 -22.25 21.22 Favored 'Trans proline' 0 C--N 1.384 2.416 0 C-N-CA 123.531 2.821 . . . . 0.0 114.48 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -77.39 -35.78 54.03 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.507 0.323 . . . . 0.0 111.489 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -82.9 0.38 44.58 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.071 0.549 . . . . 0.0 111.242 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.1 m -70.67 140.83 51.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.43 0.692 . . . . 0.0 109.669 171.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -132.06 156.49 46.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.267 0.627 . . . . 0.0 111.811 -167.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -95.41 112.28 24.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.528 1.131 . . . . 0.0 109.351 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.3 mp0 -116.95 144.39 33.41 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.612 0.765 . . . . 0.0 109.435 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.82 160.5 49.42 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 123.081 2.521 . . . . 0.0 112.171 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -50.33 -28.59 8.17 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 125.921 1.688 . . . . 0.0 114.629 -167.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.734 ' HG2' HH22 ' B' ' 8' ' ' ARG . 39.4 tt0 -64.1 -30.11 71.2 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.587 0.755 . . . . 0.0 112.224 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.541 ' HE1' HG22 ' A' ' 24' ' ' VAL . 1.1 p80 -64.1 -22.52 66.97 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.48 114.24 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.18 0.592 . . . . 0.0 109.53 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.3 mt -85.04 -63.88 1.25 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -77.75 118.37 71.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.003 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.79 -25.61 39.38 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.501 2.134 . . . . 0.0 111.961 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -70.98 -16.69 62.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.667 0.787 . . . . 0.0 111.03 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' B' ' 5' ' ' GLN . 14.5 tp -60.48 -52.92 63.16 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.964 . . . . 0.0 111.255 172.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.2 t -76.35 -38.65 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.274 0.63 . . . . 0.0 109.764 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtm -67.95 -27.99 67.08 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.229 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.24 -43.85 49.3 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.976 0.353 . . . . 0.0 110.051 175.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -56.19 -54.81 40.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.056 0.542 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.479 0.989 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.971 179.9 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.487 ' HB2' HD11 ' A' ' 47' ' ' LEU . 21.7 pt20 . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 11.2 m -127.11 141.65 51.71 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.279 0.632 . . . . 0.0 110.37 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.84 148.76 31.23 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.136 0.974 . . . . 0.0 109.819 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.734 HH22 ' HG2' ' A' ' 40' ' ' GLU . 70.3 mtm-85 . . . . . 0 N--CA 1.478 0.959 0 C-N-CA 123.218 0.607 . . . . 0.0 110.783 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.487 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.3 mp0 . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 120.282 0.087 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 m -115.72 125.61 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.948 0.899 . . . . 0.0 110.439 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 83.4 m-85 -122.36 155.89 35.08 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.011 0.524 . . . . 0.0 110.499 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.45 110.32 3.08 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.072 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.498 HG23 HD13 ' A' ' 47' ' ' LEU . 16.4 m -84.16 154.66 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.54 0.736 . . . . 0.0 110.391 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.2 tt0 -91.23 -65.64 1.0 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 171.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.3 m -163.44 175.51 10.7 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.329 1.452 . . . . 0.0 108.251 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.509 HD11 ' HB3' ' A' ' 22' ' ' TYR . 34.7 mm -74.78 119.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 165.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -74.19 -45.04 50.93 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -156.38 159.69 38.98 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.237 0.615 . . . . 0.0 109.928 -175.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -149.91 147.55 28.05 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.328 0.651 . . . . 0.0 109.905 -172.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -168.2 -173.99 2.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.22 1.008 . . . . 0.0 109.323 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -126.56 123.13 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.737 0.815 . . . . 0.0 108.893 173.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -150.07 150.35 31.6 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.93 24.85 13.78 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.625 1.17 . . . . 0.0 111.128 -173.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.71 16.05 67.38 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-N 116.102 -0.499 . . . . 0.0 113.235 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -126.7 145.85 50.43 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.466 1.106 . . . . 0.0 109.219 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.18 112.5 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -96.08 140.67 30.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.406 0.683 . . . . 0.0 109.977 -175.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HB3' HD11 ' A' ' 10' ' ' ILE . 93.3 m-85 -125.97 109.8 12.87 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.993 0.917 . . . . 0.0 109.077 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.7 tp -68.87 89.44 0.4 Allowed 'General case' 0 C--N 1.344 0.355 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.637 HG23 ' HE2' ' A' ' 41' ' ' HIS . 89.9 t -85.93 115.98 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 122.85 0.46 . . . . 0.0 109.886 -174.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -79.23 111.38 15.41 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.3 m95 -83.41 130.01 35.02 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.9 ttpt -62.09 -51.23 68.77 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.08 8.78 59.5 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 123.204 0.315 . . . . 0.0 113.658 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 65.8 m95 -123.42 137.96 29.33 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.084 0.954 . . . . 0.0 109.338 -174.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.497 ' HG2' ' CD1' ' A' ' 33' ' ' TYR . 29.7 Cg_endo -63.87 153.7 74.13 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 122.946 2.431 . . . . 0.0 113.212 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -38.53 -47.95 2.55 Favored 'Trans proline' 0 C--N 1.389 2.707 1 C-N-CA 125.888 4.392 . . . . 0.0 117.293 -171.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -72.36 -17.58 61.82 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -171.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.497 ' CD1' ' HG2' ' A' ' 30' ' ' PRO . 76.8 m-85 -84.6 7.54 19.82 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.246 0.618 . . . . 0.0 111.961 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.6 p -68.49 124.24 23.03 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 167.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 p -112.33 142.15 45.19 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.158 0.583 . . . . 0.0 111.086 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -77.14 81.71 3.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.784 0.834 . . . . 0.0 109.17 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -94.08 127.51 44.69 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.174 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.43 175.84 9.52 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.425 2.083 . . . . 0.0 113.263 -173.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.07 -34.2 9.27 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.794 1.637 . . . . 0.0 113.797 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -58.58 -30.02 66.86 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.737 1.215 . . . . 0.0 112.934 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HE2' HG23 ' A' ' 24' ' ' VAL . 2.0 p-80 -84.48 -16.76 41.34 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -170.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.4 mm -67.31 123.37 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.065 0.546 . . . . 0.0 109.882 -176.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.517 HD23 ' HG2' ' B' ' 8' ' ' ARG . 30.0 mt -99.22 -44.82 6.11 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.822 0.344 . . . . 0.0 110.469 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 26.3 t70 -110.74 129.27 24.14 Favored Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.67 -176.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.26 -27.03 41.38 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 123.107 2.538 . . . . 0.0 113.571 -175.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.594 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 41.4 mmt180 -70.13 -15.68 63.0 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.947 0.499 . . . . 0.0 111.507 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.498 HD13 HG23 ' A' ' 7' ' ' VAL . 18.9 tp -58.91 -44.43 91.25 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.549 0.74 . . . . 0.0 110.368 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -89.13 -35.9 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.316 0.646 . . . . 0.0 110.664 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.594 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 75.8 mmm -68.76 -33.94 74.74 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.028 0.931 . . . . 0.0 112.243 -175.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.07 -28.42 63.32 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.582 0.353 . . . . 0.0 110.497 175.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -75.24 -45.42 40.26 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.242 1.017 . . . . 0.0 111.65 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 . . . . . 0 N--CA 1.475 0.823 0 C-N-CA 122.855 0.462 . . . . 0.0 111.059 -175.202 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.572 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.4 mp0 . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 5.1 p -122.98 162.91 21.41 Favored 'General case' 0 C--O 1.248 1.021 0 C-N-CA 124.079 0.952 . . . . 0.0 110.22 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . . . -157.19 126.69 6.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.408 -172.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.517 ' HG2' HD23 ' A' ' 43' ' ' LEU . 14.8 mmt85 . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 172.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.701 0.286 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.78 140.1 18.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.126 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -134.29 141.7 47.04 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 171.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.13 113.19 4.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.294 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.447 HG23 ' O ' ' B' ' 5' ' ' GLN . 15.9 m -90.07 154.55 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.019 0.527 . . . . 0.0 111.132 -173.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' HG3' ' HZ1' ' A' ' 27' ' ' LYS . 37.9 tt0 -84.18 -68.98 0.67 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -159.4 -179.6 8.09 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mm -83.0 121.36 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -60.21 2.35 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.252 1.021 . . . . 0.0 108.54 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -137.67 169.82 17.13 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.956 0.902 . . . . 0.0 110.523 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -153.65 128.17 9.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.814 0.846 . . . . 0.0 109.083 -170.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -162.61 -173.74 3.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.222 1.009 . . . . 0.0 110.104 -176.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.38 143.89 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.148 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 4.1 ttm180 -147.98 115.07 6.16 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.108 0.963 . . . . 0.0 108.614 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 55.5 mtpt 63.84 32.43 13.39 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.159 0.984 . . . . 0.0 111.851 172.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.47 -15.15 63.01 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.261 -0.881 . . . . 0.0 113.021 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -96.58 110.68 23.04 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.689 0.796 . . . . 0.0 109.588 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.98 109.49 8.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -97.62 137.97 35.73 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 122.747 0.419 . . . . 0.0 110.32 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -115.51 110.22 18.95 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 167.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.1 tp -67.13 101.79 0.94 Allowed 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.448 HG22 ' CE1' ' A' ' 41' ' ' HIS . 71.9 t -97.42 122.62 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 122.221 0.209 . . . . 0.0 111.092 -172.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -78.57 119.46 21.87 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -89.0 140.55 29.32 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.97 0.908 . . . . 0.0 109.429 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HZ1' ' HG3' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -62.0 -51.46 67.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.063 0.545 . . . . 0.0 112.399 -168.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.43 9.14 78.12 Favored Glycine 0 C--N 1.346 1.084 0 N-CA-C 114.071 0.388 . . . . 0.0 114.071 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.9 m95 -127.84 137.62 31.15 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -175.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -64.2 159.01 45.27 Favored 'Trans proline' 0 C--N 1.377 2.044 0 C-N-CA 122.608 2.205 . . . . 0.0 111.812 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -60.09 -11.73 16.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.61 2.873 . . . . 0.0 115.708 -171.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -80.32 -18.32 49.51 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 118.851 0.75 . . . . 0.0 111.323 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -88.91 2.22 54.13 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.739 0.815 . . . . 0.0 111.407 172.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 t -64.13 123.53 19.3 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.2 p -119.1 156.82 29.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.689 0.796 . . . . 0.0 110.912 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -95.17 116.21 28.43 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.785 0.834 . . . . 0.0 108.833 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -119.5 149.76 48.49 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 123.497 0.719 . . . . 0.0 109.381 171.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.16 149.56 81.89 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 121.943 1.762 . . . . 0.0 110.409 168.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -56.6 -16.38 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.522 1.129 . . . . 0.0 113.991 -168.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.63 -28.44 65.66 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.757 1.223 . . . . 0.0 112.477 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.448 ' CE1' HG22 ' A' ' 24' ' ' VAL . 1.2 p80 -72.9 -15.6 61.58 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.492 HG23 HG23 ' A' ' 48' ' ' VAL . 37.4 mm -69.89 120.37 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 123.599 0.759 . . . . 0.0 109.666 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.491 HD23 ' HG3' ' B' ' 8' ' ' ARG . 26.0 mt -86.58 -15.41 39.94 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.616 0.366 . . . . 0.0 111.344 -177.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -147.9 125.86 5.91 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.201 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -55.61 -31.74 80.45 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.785 2.99 . . . . 0.0 113.86 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.454 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.3 mmt180 -65.22 -16.8 63.93 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.3 tp -69.61 -48.42 60.15 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.182 0.593 . . . . 0.0 110.595 173.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.492 HG23 HG23 ' A' ' 42' ' ' ILE . 26.1 t -69.01 -39.47 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 CA-C-O 121.439 0.638 . . . . 0.0 109.903 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.454 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 93.5 mtp -69.81 -32.57 71.09 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 114.328 -1.305 . . . . 0.0 111.236 -176.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -28.62 69.84 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.357 0.663 . . . . 0.0 111.639 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -64.48 -55.31 21.55 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.486 0.714 . . . . 0.0 110.85 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 N--CA 1.484 1.266 0 C-N-CA 123.357 0.663 . . . . 0.0 110.462 -173.841 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 7' ' ' VAL . 5.2 pm0 . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -136.43 165.74 25.11 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 123.881 0.872 . . . . 0.0 110.796 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.424 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -153.44 140.08 18.89 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.671 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.491 ' HG3' HD23 ' A' ' 43' ' ' LEU . 70.0 mtm180 . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 123.02 0.528 . . . . 0.0 109.673 174.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.5 m -82.73 138.07 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 122.989 0.516 . . . . 0.0 110.58 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -135.06 146.1 48.61 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 123.832 0.853 . . . . 0.0 108.947 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.65 120.61 13.76 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.742 0.817 . . . . 0.0 109.55 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 9.5 m -95.78 153.48 3.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 C-N-CA 123.03 0.532 . . . . 0.0 110.183 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.507 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 36.0 tt0 -86.57 -65.59 1.0 Allowed 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 170.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -158.79 -179.27 7.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.373 1.069 . . . . 0.0 109.168 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -88.93 121.88 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 163.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -62.4 1.65 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -125.15 171.58 10.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.434 0.694 . . . . 0.0 111.476 -176.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -155.27 144.44 20.94 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 109.68 -173.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -168.56 -175.98 2.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.259 1.024 . . . . 0.0 109.41 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.14 127.9 20.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 52.2 ttt-85 -140.69 125.81 18.49 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG2' ' HG2' ' A' ' 16' ' ' ARG . 72.7 mmtt 64.44 25.16 13.3 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.48 1.112 . . . . 0.0 111.507 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.65 74.53 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.156 -0.474 . . . . 0.0 113.204 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -89.89 110.6 21.54 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.021 0.928 . . . . 0.0 108.905 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 t -77.88 105.47 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.71 137.3 36.82 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.264 0.626 . . . . 0.0 110.019 -169.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -126.51 112.57 15.72 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.9 tp -69.2 86.91 0.4 Allowed 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.34 112.6 6.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 C-N-CA 123.199 0.6 . . . . 0.0 109.656 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -77.55 110.53 12.43 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 171.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.3 m95 -82.71 153.71 25.19 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 39.6 ttmt -70.8 -60.84 2.02 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.138 0.575 . . . . 0.0 112.33 -167.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.07 6.83 77.84 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 116.252 -0.431 . . . . 0.0 113.13 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.9 m95 -118.06 134.64 23.31 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.223 1.009 . . . . 0.0 109.072 -177.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.83 171.4 12.29 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.795 2.33 . . . . 0.0 111.858 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.5 -14.53 44.89 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 122.78 2.32 . . . . 0.0 113.664 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -83.28 -6.72 59.57 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.303 0.641 . . . . 0.0 112.227 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -114.94 13.22 17.0 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.031 0.932 . . . . 0.0 110.613 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.2 m -82.37 133.42 35.22 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 27.3 p -116.16 143.39 45.56 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.912 0.885 . . . . 0.0 110.494 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -71.09 82.12 0.69 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 170.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -101.33 109.48 58.92 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.551 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.45 162.95 31.59 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.537 2.158 . . . . 0.0 113.336 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -54.05 -26.55 27.2 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.178 1.391 . . . . 0.0 112.165 174.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -56.27 -31.88 64.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.275 1.43 . . . . 0.0 111.628 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -113.36 -10.93 13.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.887 0.875 . . . . 0.0 112.097 -174.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.626 HG23 HD22 ' A' ' 47' ' ' LEU . 44.3 mm -65.61 141.63 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 170.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.552 HD12 ' HB ' ' B' ' 6' ' ' THR . 3.9 pp -113.38 -12.25 13.03 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.812 1.187 . . . . 0.0 112.214 178.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -101.26 117.02 63.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 173.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.12 -38.0 93.31 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.438 2.092 . . . . 0.0 110.323 166.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 -62.3 -23.25 66.63 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.194 0.998 . . . . 0.0 113.292 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.626 HD22 HG23 ' A' ' 42' ' ' ILE . 19.5 tp -66.52 -52.52 44.93 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 118.26 0.482 . . . . 0.0 110.674 178.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.435 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 90.7 t -72.94 -37.61 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.034 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 61.4 mtt -60.5 -38.83 85.59 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.705 0.802 . . . . 0.0 111.268 176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.06 -33.96 76.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.577 0.751 . . . . 0.0 110.581 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -69.06 -41.27 77.82 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.344 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.0 mm-40 . . . . . 0 N--CA 1.486 1.334 0 C-N-CA 122.74 0.416 . . . . 0.0 110.845 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 . . . . . 0 CA--C 1.551 1.018 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.552 ' HB ' HD12 ' A' ' 43' ' ' LEU . 27.2 m -150.72 145.15 25.61 Favored 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 123.99 0.916 . . . . 0.0 111.278 -169.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -131.36 149.66 52.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.082 0.953 . . . . 0.0 109.615 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.435 ' HG3' HD22 ' A' ' 43' ' ' LEU . 78.9 mtm180 . . . . . 0 N--CA 1.474 0.727 0 C-N-CA 124.075 0.95 . . . . 0.0 108.921 175.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 121.121 0.486 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.53 143.25 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.842 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -139.93 150.59 44.73 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.063 0.945 . . . . 0.0 109.702 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.91 131.12 45.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.925 176.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.5 m -116.46 154.27 18.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.129 0.571 . . . . 0.0 111.383 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 26.3 tt0 -85.14 -58.79 2.54 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.441 1.096 . . . . 0.0 108.503 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.8 m -174.95 -178.65 1.27 Allowed 'General case' 0 C--O 1.243 0.751 0 C-N-CA 126.525 1.93 . . . . 0.0 108.025 178.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.521 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 45.0 mm -78.18 124.5 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -61.14 1.9 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.64 0.776 . . . . 0.0 109.123 176.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -133.99 156.64 47.82 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.856 0.863 . . . . 0.0 110.148 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -145.68 141.72 28.35 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.425 0.69 . . . . 0.0 109.466 -176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -165.21 -173.17 2.77 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.398 1.079 . . . . 0.0 109.357 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -135.39 119.33 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.408 0.623 . . . . 0.0 110.359 175.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -102.21 97.62 7.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.187 0.995 . . . . 0.0 108.731 173.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp 56.58 52.75 9.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.357 1.063 . . . . 0.0 113.096 168.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 -3.19 85.85 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.731 -0.668 . . . . 0.0 113.561 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -111.89 111.76 22.94 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 36.9 t -77.77 112.94 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -96.8 138.06 34.93 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.13 0.972 . . . . 0.0 109.876 -171.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.478 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.0 m-85 -127.74 110.14 12.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.162 0.985 . . . . 0.0 109.246 -178.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -69.68 101.69 1.72 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.935 -1.505 . . . . 0.0 106.935 165.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.522 HG22 ' HE2' ' A' ' 41' ' ' HIS . 25.6 t -93.21 117.72 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 122.495 0.318 . . . . 0.0 110.383 -171.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -80.13 110.9 15.97 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 56.9 m95 -85.55 77.67 9.82 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.131 0.491 . . . . 0.0 109.895 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 85.2 tttt 52.56 -91.15 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.907 1.683 . . . . 0.0 113.022 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -121.61 14.17 9.27 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 122.877 0.275 . . . . 0.0 113.037 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 25.4 m95 -70.84 129.17 90.01 Favored Pre-proline 0 N--CA 1.473 0.698 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 171.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.42 146.4 62.76 Favored 'Trans proline' 0 C--N 1.379 2.15 0 C-N-CA 122.866 2.377 . . . . 0.0 112.068 -175.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -44.74 -29.08 3.25 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 124.623 3.549 . . . . 0.0 116.865 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -74.37 -7.46 52.95 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -104.98 0.98 28.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.998 0.919 . . . . 0.0 111.745 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.6 p -71.94 123.29 22.4 Favored 'General case' 0 C--N 1.351 0.666 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 171.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.0 p -114.42 139.3 49.61 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 0.0 111.934 -169.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -77.49 86.3 3.85 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.328 1.051 . . . . 0.0 110.06 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -101.52 137.78 19.7 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.012 0.925 . . . . 0.0 109.916 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.11 161.41 26.4 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 122.208 1.938 . . . . 0.0 112.634 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -38.37 -33.08 0.09 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 127.291 2.236 . . . . 0.0 116.196 -171.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.78 -30.03 70.14 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.05 0.94 . . . . 0.0 112.635 -172.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.522 ' HE2' HG22 ' A' ' 24' ' ' VAL . 6.5 p-80 -71.77 -12.54 61.35 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.8 mm -71.54 128.95 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.086 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.557 HD12 ' HB ' ' B' ' 6' ' ' THR . 3.6 pp -108.52 -4.49 17.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 119.818 1.19 . . . . 0.0 112.853 176.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.437 ' HB3' HD11 ' A' ' 43' ' ' LEU . 4.9 p-10 -139.58 153.99 70.92 Favored Pre-proline 0 N--CA 1.481 1.081 0 C-N-CA 122.482 0.313 . . . . 0.0 111.484 -171.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -67.66 -40.15 10.58 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.226 1.951 . . . . 0.0 112.793 176.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -61.25 -28.22 69.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.853 0.861 . . . . 0.0 113.116 -165.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.43 -52.46 32.47 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.451 0.7 . . . . 0.0 112.496 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.11 -36.15 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-O 121.43 0.633 . . . . 0.0 110.391 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mtp -74.53 -28.34 60.92 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.319 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.48 -37.81 88.84 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.378 0.671 . . . . 0.0 110.995 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.521 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.9 t80 -54.52 -51.79 64.04 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.348 1.059 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 . . . . . 0 N--CA 1.473 0.707 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.929 -174.301 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.247 0.968 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.557 ' HB ' HD12 ' A' ' 43' ' ' LEU . 28.4 m -149.33 153.2 37.1 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.288 1.042 . . . . 0.0 110.805 -167.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.501 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -142.96 150.05 39.18 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.554 -178.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 43' ' ' LEU . 2.2 mpt_? . . . . . 0 N--CA 1.478 0.974 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.402 HG11 ' HG2' ' B' ' 8' ' ' ARG . 6.7 m -90.59 143.57 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.64 0.776 . . . . 0.0 110.503 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -139.61 138.18 35.96 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.643 0.777 . . . . 0.0 110.589 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.87 115.21 20.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 164.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.0 m -105.59 158.04 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.334 0.654 . . . . 0.0 111.576 -165.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.88 -56.14 8.86 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.773 0.67 . . . . 0.0 111.21 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -162.02 177.5 9.7 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.942 0.897 . . . . 0.0 110.225 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -83.83 119.61 33.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 157.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.477 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.7 tmt_? -71.42 -62.94 1.23 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.4 mttt -128.09 160.16 32.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.68 0.792 . . . . 0.0 110.61 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -146.34 140.23 26.25 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.815 1.246 . . . . 0.0 107.788 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -163.89 -175.57 4.14 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.127 0.571 . . . . 0.0 110.03 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.7 p -139.26 124.02 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.413 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 79.0 ttt180 -123.14 106.04 10.43 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.215 1.406 . . . . 0.0 108.569 -173.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HE2' ' HG2' ' A' ' 16' ' ' ARG . 37.3 mtmt 65.95 25.49 11.07 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.758 1.223 . . . . 0.0 111.702 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.43 -13.94 66.43 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.603 -0.271 . . . . 0.0 113.0 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -84.76 110.96 19.18 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.242 0.617 . . . . 0.0 110.275 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.519 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 41.1 t -73.2 111.57 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -107.58 144.43 34.62 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.435 0.694 . . . . 0.0 110.864 -171.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -130.2 113.92 15.05 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.042 0.937 . . . . 0.0 110.255 -175.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.2 tp -74.56 93.83 2.56 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 166.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.502 HG21 ' HE2' ' A' ' 41' ' ' HIS . 59.6 t -87.36 116.12 29.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 C-N-CA 122.69 0.396 . . . . 0.0 110.406 -173.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -74.92 113.68 12.5 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.156 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.532 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.9 m95 -84.54 132.97 34.46 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.011 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -81.97 110.62 17.39 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 123.475 0.485 . . . . 0.0 109.886 -172.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 113.16 -16.96 22.29 Favored Glycine 0 N--CA 1.473 1.108 0 O-C-N 123.724 0.64 . . . . 0.0 111.681 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.532 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 20.6 m95 -107.83 130.54 22.67 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 123.963 0.905 . . . . 0.0 108.901 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.43 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 23.8 Cg_endo -59.96 154.61 49.43 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.444 2.096 . . . . 0.0 112.599 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -51.22 -17.8 4.31 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 124.605 3.536 . . . . 0.0 116.166 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -79.96 -35.43 37.65 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.678 0.391 . . . . 0.0 111.138 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.43 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 41.9 m-85 -77.88 -11.36 59.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.468 0.707 . . . . 0.0 111.064 173.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.444 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.2 t -61.55 132.29 52.88 Favored 'General case' 0 C--N 1.358 0.972 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.1 p -127.72 164.14 22.78 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.075 0.55 . . . . 0.0 111.572 -170.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -100.16 116.59 32.54 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.39 1.076 . . . . 0.0 109.826 -172.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.41 153.37 72.29 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 168.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.59 -177.51 3.41 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.355 2.037 . . . . 0.0 114.214 -174.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 9.8 pt-20 -52.02 -31.43 29.78 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.267 1.827 . . . . 0.0 112.687 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.65 -45.99 92.02 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.721 1.208 . . . . 0.0 112.214 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.502 ' HE2' HG21 ' A' ' 24' ' ' VAL . 1.1 p-80 -75.52 -13.7 60.37 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -170.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.8 mm -66.87 104.84 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 175.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.561 HD11 ' HB ' ' B' ' 6' ' ' THR . 20.3 mt -90.39 -51.9 5.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.98 125.46 83.82 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.034 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.44 -37.52 13.14 Favored 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 122.901 2.401 . . . . 0.0 112.313 177.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -63.03 -21.76 66.38 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.764 0.826 . . . . 0.0 111.727 -177.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.1 -50.89 71.89 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.97 0.908 . . . . 0.0 111.618 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.482 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 46.8 t -80.24 -43.4 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.967 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.7 mtt -59.68 -45.38 92.26 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.301 1.04 . . . . 0.0 112.412 -175.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -27.27 63.33 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.218 0.607 . . . . 0.0 111.143 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.21 -37.54 78.12 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.616 0.366 . . . . 0.0 110.938 172.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.0 mm-40 . . . . . 0 N--CA 1.477 0.899 0 O-C-N 123.082 0.239 . . . . 0.0 111.265 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 . . . . . 0 N--CA 1.47 0.551 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.561 ' HB ' HD11 ' A' ' 43' ' ' LEU . 10.8 p -78.99 119.91 22.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.691 -173.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.71 123.6 18.83 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.099 1.36 . . . . 0.0 108.523 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 41' ' ' HIS . 17.8 mtm-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 119.1 -0.476 . . . . 0.0 109.934 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 121.002 0.429 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.93 127.34 38.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-O 121.041 0.448 . . . . 0.0 111.086 -177.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.26 162.98 20.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.838 0.855 . . . . 0.0 109.173 174.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.54 107.42 5.05 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.281 0.633 . . . . 0.0 110.491 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 9.6 m -75.93 154.09 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.382 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.52 -66.03 0.93 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 163.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.4 m -164.64 -162.34 0.64 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.156 1.782 . . . . 0.0 107.421 174.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.456 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -85.38 137.22 21.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 164.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.573 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.8 tmt_? -88.9 -54.3 4.2 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -137.17 163.94 29.67 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.503 0.721 . . . . 0.0 110.618 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -151.49 143.54 23.92 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.144 0.977 . . . . 0.0 108.483 -173.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -164.42 168.0 18.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.683 0.793 . . . . 0.0 110.179 -176.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.8 t -116.0 125.29 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -123.54 94.9 4.38 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.295 1.038 . . . . 0.0 108.701 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.58 39.15 27.9 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.322 1.049 . . . . 0.0 111.353 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.93 -18.27 57.02 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.371 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -90.9 108.08 19.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.979 0.512 . . . . 0.0 109.688 -177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.6 t -80.66 109.41 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 55.8 mt-10 -97.14 155.42 16.83 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.603 0.716 . . . . 0.0 110.864 -176.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.456 ' HB3' HD12 ' A' ' 10' ' ' ILE . 75.2 m-85 -134.65 109.81 8.88 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.102 177.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.15 87.73 0.11 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.429 HG22 ' HE2' ' A' ' 41' ' ' HIS . 63.1 t -74.24 118.75 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -174.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.573 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 22.6 tptm -80.19 124.84 29.15 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 36.9 m95 -103.89 134.89 46.43 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.09 -38.79 66.27 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -165.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.36 14.68 60.43 Favored Glycine 0 N--CA 1.474 1.172 0 CA-C-N 116.365 -0.38 . . . . 0.0 113.535 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 69.2 m95 -135.47 135.67 22.7 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 123.658 0.783 . . . . 0.0 110.003 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.99 164.75 21.05 Favored 'Trans proline' 0 CA--C 1.569 2.229 0 C-N-CA 122.971 2.447 . . . . 0.0 112.402 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.91 -13.47 27.32 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 123.793 2.996 . . . . 0.0 114.754 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.8 -23.62 63.36 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.696 0.399 . . . . 0.0 111.866 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -103.58 3.08 34.21 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.727 0.811 . . . . 0.0 112.294 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.4 p -71.21 129.62 39.37 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 169.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 p -118.75 128.27 54.33 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.094 0.558 . . . . 0.0 112.228 -165.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -71.18 101.52 2.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.517 0.727 . . . . 0.0 109.324 173.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -133.31 134.91 24.55 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.502 0.721 . . . . 0.0 109.059 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 68.7 Cg_endo -68.91 167.39 23.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.839 2.359 . . . . 0.0 113.831 -173.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.08 -21.85 0.8 Allowed 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 125.329 1.451 . . . . 0.0 114.59 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -54.73 -44.72 73.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.591 1.156 . . . . 0.0 111.53 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.429 ' HE2' HG22 ' A' ' 24' ' ' VAL . 1.3 p-80 -83.11 -5.64 59.19 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.224 -172.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.513 HG22 HG23 ' A' ' 48' ' ' VAL . 28.5 mm -80.28 121.19 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.584 HD12 ' HG3' ' B' ' 8' ' ' ARG . 5.5 mp -88.09 -47.98 8.08 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.044 0.538 . . . . 0.0 109.606 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -100.51 130.83 24.82 Favored Pre-proline 0 CA--C 1.549 0.928 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.581 -169.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.33 -35.29 24.45 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 122.699 2.266 . . . . 0.0 113.183 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.503 ' HB2' HE21 ' B' ' 5' ' ' GLN . 56.5 mmm-85 -69.42 -16.15 63.44 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.179 0.592 . . . . 0.0 111.351 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.53 -47.05 80.26 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.238 0.615 . . . . 0.0 110.461 173.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.513 HG23 HG22 ' A' ' 42' ' ' ILE . 67.5 t -73.58 -44.31 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.583 0.753 . . . . 0.0 110.577 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -67.1 -55.46 14.17 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.008 -171.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.26 -28.36 67.99 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.496 0.718 . . . . 0.0 112.558 -174.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -55.3 -49.92 70.9 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.915 0.886 . . . . 0.0 111.06 171.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 123.748 0.819 . . . . 0.0 111.605 -176.57 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.503 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.9 mp0 . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.1 m -140.51 155.17 46.73 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 122.927 0.491 . . . . 0.0 110.122 -171.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.73 133.78 22.7 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.324 0.649 . . . . 0.0 111.365 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.584 ' HG3' HD12 ' A' ' 43' ' ' LEU . 94.7 mtt180 . . . . . 0 N--CA 1.489 1.498 0 C-N-CA 123.844 0.858 . . . . 0.0 110.125 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 . . . . . 0 N--CA 1.471 0.575 0 CA-C-O 121.336 0.589 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.467 HG13 HH11 ' B' ' 8' ' ' ARG . 35.2 m -97.06 127.58 49.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.963 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -130.15 148.53 52.0 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 124.088 0.955 . . . . 0.0 108.509 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.85 117.72 9.35 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.022 0.529 . . . . 0.0 109.627 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.445 HG12 ' CE3' ' A' ' 26' ' ' TRP . 11.2 m -99.64 150.79 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 123.171 0.588 . . . . 0.0 110.267 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.566 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 40.0 tt0 -73.62 -72.38 0.27 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -162.07 -176.42 5.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.141 1.377 . . . . 0.0 108.114 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.48 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.7 mm -71.3 124.49 27.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.466 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -76.97 -57.21 3.98 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.466 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.2 mttm -134.55 160.29 38.51 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.063 0.945 . . . . 0.0 110.421 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -145.61 134.49 22.47 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.91 0.884 . . . . 0.0 109.103 -166.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -167.24 176.58 6.66 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.213 0.605 . . . . 0.0 110.602 -178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -128.47 117.15 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -112.11 101.68 9.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.766 0.826 . . . . 0.0 109.299 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.5 tptp 52.99 53.12 12.54 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.61 1.164 . . . . 0.0 112.229 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.67 -17.06 58.68 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-N 115.324 -0.853 . . . . 0.0 114.066 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -91.82 118.75 30.99 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 174.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -83.49 102.49 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -105.93 138.59 41.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.979 0.512 . . . . 0.0 110.514 -167.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.48 ' HB3' HD12 ' A' ' 10' ' ' ILE . 22.2 m-85 -126.14 113.22 16.76 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.725 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.6 tp -64.62 100.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.975 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 164.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.458 HG21 ' CE1' ' A' ' 41' ' ' HIS . 95.3 t -100.69 129.22 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.27 109.89 19.82 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.125 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.445 ' CE3' HG12 ' A' ' 7' ' ' VAL . 27.1 m95 -83.64 106.79 15.64 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 63.4 pttt -69.26 -22.43 63.84 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -168.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.78 -36.89 92.83 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.561 0.538 . . . . 0.0 112.389 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -101.65 164.53 15.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.454 1.102 . . . . 0.0 109.48 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.69 152.64 64.68 Favored 'Trans proline' 0 CA--C 1.564 2.006 0 C-N-CA 121.612 1.541 . . . . 0.0 111.351 173.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -59.17 -8.82 7.01 Favored 'Trans proline' 0 C--N 1.388 2.639 0 C-N-CA 124.089 3.193 . . . . 0.0 115.775 -173.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -70.2 -12.72 61.79 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.05 0.386 . . . . 0.0 111.579 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -105.46 18.22 22.59 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.096 0.959 . . . . 0.0 111.286 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -68.76 116.98 9.88 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -109.81 140.48 43.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.293 0.637 . . . . 0.0 111.114 -174.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -75.46 87.33 2.61 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -102.59 127.94 29.2 Favored Pre-proline 0 CA--C 1.551 1.017 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.255 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.66 159.31 51.68 Favored 'Trans proline' 0 C--N 1.383 2.343 0 C-N-CA 123.235 2.623 . . . . 0.0 112.545 -178.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -58.95 -11.95 3.97 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -167.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.18 -33.57 69.39 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.307 1.043 . . . . 0.0 110.696 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.538 ' ND1' ' HB1' ' B' ' 7' ' ' ALA . 0.3 OUTLIER -79.76 -13.51 59.39 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -174.348 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mm -72.46 122.1 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.914 0.886 . . . . 0.0 110.515 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.7 mt -106.1 -0.92 24.34 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.773 0.429 . . . . 0.0 111.643 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -145.43 128.0 8.1 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 109.427 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -62.66 -43.72 20.18 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.627 2.218 . . . . 0.0 112.527 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.534 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 58.7 mtt180 -70.41 -15.48 62.84 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.833 0.853 . . . . 0.0 111.648 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.0 tp -53.63 -46.03 70.35 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.326 0.65 . . . . 0.0 110.213 168.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.82 -39.44 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 124.044 0.938 . . . . 0.0 111.317 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.534 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 20.2 mmt -71.68 -45.06 63.08 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.684 0.794 . . . . 0.0 111.874 -171.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.92 -26.91 65.33 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.506 0.722 . . . . 0.0 111.867 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -54.56 -44.2 72.7 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.123 0.569 . . . . 0.0 110.883 174.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 . . . . . 0 N--CA 1.476 0.856 0 C-N-CA 122.841 0.456 . . . . 0.0 111.671 -178.586 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.422 ' O ' HG22 ' A' ' 7' ' ' VAL . 19.4 mp0 . . . . . 0 C--O 1.239 0.548 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 m -121.61 150.09 42.21 Favored 'General case' 0 C--O 1.249 1.051 0 C-N-CA 123.832 0.853 . . . . 0.0 109.425 -174.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.538 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -156.34 147.0 21.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.279 0.632 . . . . 0.0 111.136 -175.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.467 HH11 HG13 ' A' ' 4' ' ' VAL . 2.2 mpt_? . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.478 0.711 . . . . 0.0 110.127 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.18 119.53 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -118.66 157.31 27.68 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.675 0.79 . . . . 0.0 109.625 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.51 123.86 21.99 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.054 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.484 HG21 HD12 ' A' ' 47' ' ' LEU . 12.4 m -97.1 153.28 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 123.696 0.798 . . . . 0.0 111.097 -173.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -81.95 -78.5 0.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 163.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.6 m -161.22 -173.75 4.0 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.997 1.319 . . . . 0.0 107.759 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.633 HD12 ' HB3' ' A' ' 22' ' ' TYR . 43.0 mm -81.09 115.72 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 169.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -57.68 6.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.123 0.969 . . . . 0.0 109.382 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -136.44 162.45 33.02 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.154 0.982 . . . . 0.0 110.008 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -146.58 141.09 26.6 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.706 0.803 . . . . 0.0 108.89 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -162.89 -176.57 4.99 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.687 1.195 . . . . 0.0 108.966 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.478 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 23.9 t -128.21 144.95 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -147.16 116.95 7.15 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt 65.73 28.74 10.95 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.563 1.145 . . . . 0.0 110.747 175.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.1 -12.97 58.76 Favored Glycine 0 C--N 1.352 1.455 0 CA-C-N 115.485 -0.779 . . . . 0.0 113.011 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -95.79 112.37 24.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.284 0.634 . . . . 0.0 109.639 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.478 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.0 t -70.41 119.95 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.451 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -94.0 142.35 27.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.514 0.725 . . . . 0.0 109.658 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.633 ' HB3' HD12 ' A' ' 10' ' ' ILE . 97.7 m-85 -130.4 108.08 9.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.284 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.96 84.51 0.08 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.03 109.54 2.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -77.62 124.97 28.62 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 172.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m95 -97.84 136.53 38.03 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 28' ' ' GLY . 0.1 OUTLIER -65.25 -31.12 72.11 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -168.032 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.511 ' N ' ' HD3' ' A' ' 27' ' ' LYS . . . -97.78 2.56 60.33 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.946 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 60.4 m95 -124.58 133.36 24.69 Favored Pre-proline 0 N--CA 1.471 0.61 0 C-N-CA 123.576 0.75 . . . . 0.0 109.647 -172.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.12 165.18 12.94 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.028 2.485 . . . . 0.0 112.277 174.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -57.53 -23.36 56.01 Favored 'Trans proline' 0 C--N 1.39 2.745 0 C-N-CA 123.254 2.636 . . . . 0.0 114.154 -176.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.572 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -66.79 -13.33 61.35 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.13 0.572 . . . . 0.0 112.495 177.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.402 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 81.9 m-85 -113.86 1.39 14.76 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.585 0.754 . . . . 0.0 112.306 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.9 p -69.14 130.29 42.27 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 171.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.2 p -117.78 138.57 51.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.084 0.554 . . . . 0.0 111.404 -169.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -72.87 84.66 1.23 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.638 0.775 . . . . 0.0 109.087 176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -96.95 116.33 66.03 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.445 0.698 . . . . 0.0 109.131 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.72 176.2 4.55 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.464 2.109 . . . . 0.0 113.882 -175.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -50.41 -36.31 32.36 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.96 1.704 . . . . 0.0 113.212 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -60.84 -34.88 75.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.404 1.082 . . . . 0.0 112.382 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -83.37 -23.64 32.35 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.354 0.662 . . . . 0.0 112.258 -173.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.526 HG23 HG21 ' A' ' 48' ' ' VAL . 27.0 mm -71.93 108.45 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.563 HD13 ' HB ' ' B' ' 6' ' ' THR . 4.6 pp -99.46 -24.5 14.76 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 117.667 0.212 . . . . 0.0 111.505 -173.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -104.11 120.54 50.64 Favored Pre-proline 0 N--CA 1.475 0.801 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -64.83 -20.12 64.53 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.3 2.0 . . . . 0.0 111.583 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -61.19 -20.51 62.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.835 1.254 . . . . 0.0 112.222 177.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.496 ' HA ' HE21 ' B' ' 5' ' ' GLN . 16.7 tp -71.72 -47.49 53.54 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.056 0.542 . . . . 0.0 111.164 178.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.526 HG21 HG23 ' A' ' 42' ' ' ILE . 78.8 t -77.67 -37.72 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.346 0.658 . . . . 0.0 110.682 179.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.6 mmt -67.08 -41.06 87.01 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.14 -178.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.91 70.31 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.278 0.561 . . . . 0.0 111.493 178.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -71.8 -53.24 13.97 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.231 1.013 . . . . 0.0 110.937 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 122.795 0.438 . . . . 0.0 111.236 -173.635 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.496 HE21 ' HA ' ' A' ' 47' ' ' LEU . 49.0 tt0 . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.563 ' HB ' HD13 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -147.85 152.6 37.9 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.434 0.635 . . . . 0.0 111.692 -172.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.88 160.62 37.11 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.392 1.077 . . . . 0.0 109.494 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 . . . . . 0 C--O 1.238 0.466 0 C-N-CA 124.246 1.019 . . . . 0.0 109.198 175.781 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -96.79 140.88 16.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -130.26 142.03 50.58 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.264 0.626 . . . . 0.0 109.461 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 126.91 30.68 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.729 169.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.99 154.66 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.022 0.439 . . . . 0.0 111.565 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 42.9 tt0 -78.33 -63.57 1.37 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.946 172.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.6 m -165.56 173.39 10.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.681 1.192 . . . . 0.0 110.073 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.455 HD12 ' HB3' ' A' ' 22' ' ' TYR . 41.3 mm -85.11 126.59 40.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 162.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -52.79 6.26 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HA ' ' HH ' ' A' ' 51' ' ' TYR . 99.1 mttt -138.99 170.04 16.7 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.829 0.852 . . . . 0.0 110.17 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -156.61 145.63 20.29 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.131 0.573 . . . . 0.0 110.094 -173.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -159.93 169.88 22.55 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.896 0.878 . . . . 0.0 109.208 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.41 115.91 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 166.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -137.0 126.45 25.04 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -174.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 65.46 24.95 11.91 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.016 0.913 . . . . 0.0 110.374 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.89 -9.05 47.31 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.282 -0.872 . . . . 0.0 113.18 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -93.92 111.43 23.14 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 123.988 0.915 . . . . 0.0 108.918 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.405 ' HB ' ' HG3' ' A' ' 39' ' ' GLU . 23.6 t -77.17 106.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -98.4 138.6 35.4 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 123.96 0.904 . . . . 0.0 110.288 -173.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.455 ' HB3' HD12 ' A' ' 10' ' ' ILE . 59.0 m-85 -122.61 117.25 25.39 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 tp -71.07 81.77 0.69 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.592 HG23 ' HE2' ' A' ' 41' ' ' HIS . 85.6 t -75.88 110.35 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.009 -169.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -75.39 107.44 7.51 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.637 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 52.7 m95 -75.78 147.83 38.93 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.093 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.6 OUTLIER -64.46 -54.49 31.79 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.164 0.586 . . . . 0.0 112.146 -169.192 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.81 13.19 64.0 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 116.207 -0.451 . . . . 0.0 113.796 -175.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.637 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 70.5 m95 -117.78 141.43 29.08 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 123.526 0.73 . . . . 0.0 109.772 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.401 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 41.3 Cg_endo -64.59 160.83 38.06 Favored 'Trans proline' 0 CA--C 1.563 1.932 0 C-N-CA 122.904 2.403 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.16 -20.37 46.13 Favored 'Trans proline' 0 C--N 1.389 2.659 0 C-N-CA 123.604 2.869 . . . . 0.0 115.184 -177.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -74.22 -19.81 60.39 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.401 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 39.3 m-85 -96.22 5.72 50.4 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.793 0.837 . . . . 0.0 111.897 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.9 p -68.36 117.85 10.68 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.7 p -106.06 144.29 32.99 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.503 0.721 . . . . 0.0 110.797 -173.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.04 80.03 1.71 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.051 0.929 . . . . 0.0 109.889 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -83.82 120.79 75.59 Favored Pre-proline 0 C--O 1.242 0.682 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.953 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.35 155.63 69.04 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 121.933 1.755 . . . . 0.0 111.428 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.405 ' HG3' ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -49.89 -19.89 0.78 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.686 1.595 . . . . 0.0 114.849 -177.332 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -55.35 -32.72 62.78 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.461 1.104 . . . . 0.0 112.854 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.592 ' HE2' HG23 ' A' ' 24' ' ' VAL . 2.8 p-80 -82.07 -12.22 58.37 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.89 120.63 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.935 0.894 . . . . 0.0 110.335 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.461 HD11 HG21 ' B' ' 6' ' ' THR . 38.0 mt -110.02 2.23 19.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.756 0.423 . . . . 0.0 110.985 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -150.89 127.19 5.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.328 0.651 . . . . 0.0 110.622 -174.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.32 -37.33 40.74 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.943 2.428 . . . . 0.0 112.199 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -64.81 -18.49 65.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.452 0.701 . . . . 0.0 111.478 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.87 -52.59 48.98 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.224 0.61 . . . . 0.0 111.314 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.05 -37.64 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-O 121.567 0.699 . . . . 0.0 110.075 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.6 mmt -70.98 -29.24 65.15 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.847 -178.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -30.56 70.76 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.007 0.432 . . . . 0.0 110.692 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.409 ' HH ' ' HA ' ' A' ' 12' ' ' LYS . 68.1 t80 -76.07 -56.29 4.79 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.543 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 N--CA 1.481 1.113 0 C-N-CA 123.079 0.551 . . . . 0.0 110.934 -171.621 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.835 0 CA-C-O 121.802 0.811 . . . . 0.0 109.265 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.461 HG21 HD11 ' A' ' 43' ' ' LEU . 13.0 m -117.87 150.99 38.27 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.913 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -151.56 129.53 11.77 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.976 -175.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 123.838 0.855 . . . . 0.0 110.792 172.545 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.448 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 1.8 mp0 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -105.35 130.37 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.448 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 37.3 m-85 -130.18 164.05 25.32 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.545 0.738 . . . . 0.0 109.747 179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.35 115.05 5.87 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.517 HG21 HD11 ' A' ' 47' ' ' LEU . 14.2 m -79.94 156.06 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 123.085 0.554 . . . . 0.0 110.242 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.565 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 37.1 tt0 -85.75 -67.93 0.77 Allowed 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 161.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 m -164.99 -167.79 1.29 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.157 1.383 . . . . 0.0 108.142 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' HB3' ' A' ' 22' ' ' TYR . 46.4 mm -91.93 133.2 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 163.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -88.22 -54.8 4.03 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.406 ' HA ' ' HH ' ' A' ' 51' ' ' TYR . 97.7 mttt -136.83 176.87 8.32 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.718 0.807 . . . . 0.0 110.583 -178.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -153.62 144.7 22.88 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -160.18 -175.04 4.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.923 0.889 . . . . 0.0 109.272 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.9 p -142.81 132.5 22.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 173.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -134.27 105.4 6.61 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.134 0.974 . . . . 0.0 109.101 -172.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.6 39.52 29.79 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.79 1.236 . . . . 0.0 111.566 -178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.92 -18.27 56.26 Favored Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.811 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -87.13 110.57 20.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 117.077 0.438 . . . . 0.0 110.764 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -75.06 110.15 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.615 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 34.8 mt-10 -101.11 146.69 27.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.472 0.709 . . . . 0.0 110.538 -173.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.433 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.9 m-85 -127.16 119.25 26.02 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.3 tp -70.46 82.84 0.58 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.97 107.19 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -176.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -77.58 118.94 20.47 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.6 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 40.1 m95 -92.61 149.43 21.35 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.565 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 3.5 tppp? -61.13 -51.61 68.35 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.189 0.996 . . . . 0.0 112.991 -167.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.93 6.53 76.63 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.61 -0.328 . . . . 0.0 113.576 -177.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.6 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 36.1 m95 -121.46 132.52 24.2 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.806 0.843 . . . . 0.0 109.632 -169.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 47.3 Cg_endo -66.03 165.96 22.32 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.974 2.449 . . . . 0.0 112.78 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.0 0.44 2.57 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 123.46 2.773 . . . . 0.0 115.207 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -91.88 -31.61 15.62 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 118.233 0.469 . . . . 0.0 111.077 168.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.434 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 49.4 m-85 -86.08 -1.75 57.68 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.461 0.705 . . . . 0.0 111.343 175.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.1 p -70.9 141.09 51.18 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 168.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.68 141.54 51.58 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.818 0.447 . . . . 0.0 111.935 -170.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -76.35 85.29 3.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.202 1.001 . . . . 0.0 110.282 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -95.22 114.63 64.2 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.513 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.615 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 71.9 Cg_exo -53.63 172.35 0.25 Allowed 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 123.653 2.902 . . . . 0.0 114.845 176.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.26 66.29 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.857 -176.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -70.72 -29.27 65.5 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.897 0.479 . . . . 0.0 111.352 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -77.22 -33.03 56.25 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.231 0.612 . . . . 0.0 110.624 177.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.584 HG22 HD23 ' A' ' 47' ' ' LEU . 36.0 mm -71.79 116.9 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.1 15.39 23.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.565 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -134.37 127.97 19.07 Favored Pre-proline 0 N--CA 1.476 0.829 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.24 -56.53 1.54 Allowed 'Trans proline' 0 C--N 1.378 2.094 0 C-N-CA 122.594 2.196 . . . . 0.0 112.183 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.515 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 84.6 mtt85 -69.54 -15.27 63.2 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.75 0.82 . . . . 0.0 112.993 -170.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.584 HD23 HG22 ' A' ' 42' ' ' ILE . 23.8 tp -56.94 -44.36 82.45 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-O 121.121 0.486 . . . . 0.0 110.126 169.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.493 HG21 HG21 ' A' ' 42' ' ' ILE . 53.8 t -84.25 -48.85 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.469 1.107 . . . . 0.0 111.122 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.515 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.7 mmt -62.41 -37.97 87.86 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.214 -170.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.94 -45.43 85.81 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.818 0.447 . . . . 0.0 111.137 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.406 ' HH ' ' HA ' ' A' ' 12' ' ' LYS . 8.7 t80 -54.41 -50.73 66.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.088 0.955 . . . . 0.0 111.445 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.149 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.9 p -141.85 159.61 41.87 Favored 'General case' 0 C--O 1.256 1.445 0 C-N-CA 123.902 0.881 . . . . 0.0 110.258 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.56 141.79 30.83 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.432 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 . . . . . 0 N--CA 1.471 0.578 0 C-N-CA 123.399 0.68 . . . . 0.0 109.406 179.03 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.445 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.4 m -131.1 98.41 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.754 1.222 . . . . 0.0 109.426 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.16 156.29 22.54 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.133 0.573 . . . . 0.0 111.372 -172.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.25 139.67 38.89 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.018 169.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.1 m -120.23 157.11 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.68 0.792 . . . . 0.0 110.646 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 5.9 tp10 -61.5 -65.21 0.73 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 164.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.01 -179.52 4.69 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.479 1.112 . . . . 0.0 109.412 -179.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.8 mm -75.19 106.33 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 161.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -63.07 -54.01 44.65 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.366 0.667 . . . . 0.0 110.191 -178.104 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -138.62 172.96 12.11 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.408 0.683 . . . . 0.0 110.389 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -153.39 127.17 8.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.852 0.861 . . . . 0.0 108.779 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.87 178.43 9.16 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.357 0.663 . . . . 0.0 110.373 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.62 116.05 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.759 0.824 . . . . 0.0 108.962 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -131.53 121.65 24.81 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.6 tptt 65.62 26.41 11.57 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.518 1.127 . . . . 0.0 110.672 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.66 -13.39 58.7 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.821 -176.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -86.95 110.55 20.1 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.261 0.625 . . . . 0.0 109.483 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.9 t -77.79 107.24 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -104.05 136.14 44.25 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.901 0.481 . . . . 0.0 110.275 -172.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -113.92 121.06 42.79 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.507 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.9 tp -71.36 113.93 8.91 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.403 HG21 ' CE1' ' A' ' 41' ' ' HIS . 13.1 t -100.5 108.14 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -170.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -77.3 110.39 11.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.238 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' SER . 38.8 m95 -87.18 133.31 33.66 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -80.34 -50.08 10.65 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.346 0.658 . . . . 0.0 111.543 -172.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.75 -4.19 87.84 Favored Glycine 0 CA--C 1.54 1.65 0 N-CA-C 114.03 0.372 . . . . 0.0 114.03 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.5 m95 -120.28 149.43 49.53 Favored Pre-proline 0 N--CA 1.48 1.036 0 C-N-CA 124.247 1.019 . . . . 0.0 109.956 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.06 150.97 87.25 Favored 'Trans proline' 0 C--N 1.382 2.298 0 C-N-CA 122.685 2.257 . . . . 0.0 112.601 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -54.75 -30.39 66.87 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 124.507 3.472 . . . . 0.0 116.013 -167.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -73.02 -17.02 61.48 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -78.97 -1.36 34.98 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.909 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.442 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 57.0 m -67.12 116.51 8.0 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 174.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 p -97.97 141.24 31.18 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.138 0.975 . . . . 0.0 111.139 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -78.96 105.6 10.4 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 167.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.418 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 13.1 mm-40 -121.34 126.99 26.33 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.236 1.014 . . . . 0.0 109.402 -173.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -57.26 142.43 94.71 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 123.565 2.843 . . . . 0.0 111.87 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -54.4 -24.36 19.45 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -164.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.88 -24.81 67.99 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 124.265 1.026 . . . . 0.0 112.003 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' HB3' ' A' ' 37' ' ' GLU . 2.7 p80 -70.43 -19.49 62.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.458 0.703 . . . . 0.0 112.457 -174.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.587 HG22 HD22 ' A' ' 47' ' ' LEU . 36.8 mm -71.44 134.08 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.334 0.654 . . . . 0.0 109.432 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.506 HD13 ' HB ' ' B' ' 6' ' ' THR . 31.7 mt -100.15 5.12 44.81 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.154 0.582 . . . . 0.0 111.534 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.477 ' H ' HG23 ' A' ' 42' ' ' ILE . 32.5 t70 -151.13 125.34 4.48 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 122.757 0.423 . . . . 0.0 111.379 -174.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -64.55 -37.05 39.77 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.526 2.151 . . . . 0.0 112.699 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.447 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 88.8 mtt-85 -68.27 -15.12 63.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.487 0.715 . . . . 0.0 111.989 -175.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.587 HD22 HG22 ' A' ' 42' ' ' ILE . 12.0 tp -69.06 -52.51 27.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.384 0.674 . . . . 0.0 110.598 173.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.18 -33.43 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 121.594 0.711 . . . . 0.0 109.609 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.447 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 97.7 mmm -73.74 -29.38 62.2 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.971 176.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.3 -29.68 69.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.563 0.345 . . . . 0.0 110.347 174.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -71.7 -57.72 4.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.39 0.676 . . . . 0.0 110.709 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 . . . . . 0 N--CA 1.478 0.958 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.31 -168.694 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.461 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.7 mm100 . . . . . 0 N--CA 1.471 0.596 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.506 ' HB ' HD13 ' A' ' 43' ' ' LEU . 19.4 p -74.66 128.74 36.29 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.475 0.71 . . . . 0.0 111.119 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.45 134.85 36.29 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.445 ' HG2' HG12 ' A' ' 4' ' ' VAL . 97.0 mtt180 . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 121.822 0.82 . . . . 0.0 112.503 -177.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 . . . . . 0 CA--C 1.543 0.681 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.7 m -111.49 148.2 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.043 0.937 . . . . 0.0 110.58 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -146.78 164.07 33.97 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.816 0.847 . . . . 0.0 111.258 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.68 126.01 28.59 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.071 173.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.402 HG23 HD13 ' A' ' 47' ' ' LEU . 35.8 m -104.95 151.45 7.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 124.051 0.94 . . . . 0.0 111.025 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -86.17 -70.52 0.59 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 168.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.8 m -162.4 -177.63 5.78 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 125.176 1.39 . . . . 0.0 108.544 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.563 HD13 ' HB3' ' A' ' 22' ' ' TYR . 50.1 mm -76.5 119.84 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 168.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.11 -50.89 36.14 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -142.67 158.15 43.95 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.78 0.832 . . . . 0.0 110.565 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -142.76 125.46 15.93 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.303 0.641 . . . . 0.0 109.824 -169.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -154.52 175.22 13.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.568 0.747 . . . . 0.0 109.546 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.566 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 11.5 p -118.31 142.94 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 171.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -150.57 120.87 7.31 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.805 0.842 . . . . 0.0 108.983 -176.264 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 27.7 mtpp 60.98 29.45 19.02 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.396 1.078 . . . . 0.0 111.747 178.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.3 -13.44 65.12 Favored Glycine 0 C--N 1.353 1.51 0 CA-C-N 116.091 -0.504 . . . . 0.0 113.457 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -103.72 117.6 34.77 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.729 0.811 . . . . 0.0 110.092 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 53.0 t -69.33 110.14 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.621 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 69.5 mt-10 -98.7 144.51 27.89 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.203 1.001 . . . . 0.0 110.477 -176.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.563 ' HB3' HD13 ' A' ' 10' ' ' ILE . 74.5 m-85 -126.78 116.95 21.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.726 -1.124 . . . . 0.0 108.573 -174.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.58 102.2 0.88 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 166.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -87.65 117.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -81.65 113.38 19.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 172.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -84.26 125.28 32.09 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -61.19 -43.1 99.42 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.482 0.713 . . . . 0.0 112.048 -169.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.78 4.55 83.54 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-O 119.609 -0.551 . . . . 0.0 114.177 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 39.0 m95 -120.99 143.12 36.11 Favored Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 123.499 0.72 . . . . 0.0 110.177 -178.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.37 152.13 82.71 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.93 2.42 . . . . 0.0 111.914 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.75 -34.1 5.46 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 124.893 3.729 . . . . 0.0 117.108 -171.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -69.98 -17.37 63.29 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.812 0.733 . . . . 0.0 112.816 -173.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -88.54 4.97 44.89 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.854 0.462 . . . . 0.0 111.713 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -64.15 124.25 21.18 Favored 'General case' 0 C--N 1.351 0.655 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.0 p -112.13 127.3 55.89 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.291 0.636 . . . . 0.0 112.009 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -75.88 78.91 2.78 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.789 0.835 . . . . 0.0 109.919 175.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -104.47 143.69 27.2 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 92.4 Cg_endo -77.97 176.72 9.66 Favored 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 122.264 1.976 . . . . 0.0 113.474 -172.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -48.21 -22.45 0.66 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.887 1.675 . . . . 0.0 113.816 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -56.61 -31.01 63.88 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.69 1.596 . . . . 0.0 113.289 175.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.608 ' HD2' ' HB2' ' B' ' 7' ' ' ALA . 9.4 p-80 -87.13 -8.83 56.59 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.225 0.61 . . . . 0.0 112.359 -168.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 26.4 mm -80.18 122.69 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.124 0.569 . . . . 0.0 110.956 -171.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.571 HD13 ' HG3' ' B' ' 8' ' ' ARG . 6.8 mp -96.29 -15.97 21.63 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 177.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -150.94 130.46 6.6 Favored Pre-proline 0 N--CA 1.473 0.677 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -176.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.63 -25.35 54.56 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 123.162 2.575 . . . . 0.0 113.692 -173.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.12 -19.53 61.61 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.004 0.522 . . . . 0.0 111.546 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.402 HD13 HG23 ' A' ' 7' ' ' VAL . 10.7 tp -60.29 -47.21 87.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.881 0.472 . . . . 0.0 110.994 176.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.37 -46.65 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.512 0.725 . . . . 0.0 110.448 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -62.46 -54.26 42.71 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.762 -175.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.23 70.04 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.13 0.423 . . . . 0.0 111.692 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.17 -56.92 15.59 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.898 0.479 . . . . 0.0 109.955 172.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 123.178 0.591 . . . . 0.0 111.044 179.456 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 120.722 0.296 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 10.9 m 70.05 138.59 0.04 OUTLIER 'General case' 0 C--O 1.253 1.287 0 C-N-CA 124.604 1.162 . . . . 0.0 112.231 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.608 ' HB2' ' HD2' ' A' ' 41' ' ' HIS . . . -146.37 135.39 22.57 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.334 -175.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.571 ' HG3' HD13 ' A' ' 43' ' ' LEU . 44.7 mtp180 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 166.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 112.05 -0.42 . . . . 0.0 112.05 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.93 150.79 20.84 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.016 0.527 . . . . 0.0 110.496 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -79.75 95.03 5.87 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.382 0.673 . . . . 0.0 110.252 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.6 m -124.77 142.51 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.651 0.78 . . . . 0.0 110.614 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -135.41 163.21 30.55 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.285 1.034 . . . . 0.0 109.173 176.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.03 105.72 3.43 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.4 0.68 . . . . 0.0 109.376 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG11 ' CZ3' ' A' ' 26' ' ' TRP . 1.6 m -87.56 154.13 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.906 -176.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -82.08 -79.99 0.17 Allowed 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.0 m -160.21 -174.04 4.33 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.517 1.127 . . . . 0.0 108.804 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.549 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.4 mm -80.88 134.72 26.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 172.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.73 4.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.902 0.881 . . . . 0.0 109.571 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -133.43 153.72 51.37 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.979 0.911 . . . . 0.0 109.306 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -135.73 135.32 39.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.7 ptm85 -162.47 173.36 14.15 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.606 0.762 . . . . 0.0 110.106 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.425 HG21 HG23 ' A' ' 20' ' ' VAL . 14.4 t -119.34 119.9 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 175.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -118.93 110.75 17.52 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.985 0.914 . . . . 0.0 110.059 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp 60.55 31.5 20.26 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 124.287 1.035 . . . . 0.0 111.832 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.48 10.04 62.42 Favored Glycine 0 C--N 1.352 1.467 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.377 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.591 ' HZ3' ' HB2' ' A' ' 40' ' ' GLU . 30.9 mmmt -124.64 111.82 16.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.956 0.903 . . . . 0.0 109.98 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.425 HG23 HG21 ' A' ' 15' ' ' VAL . 38.4 t -70.62 108.15 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.699 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 18.9 pt-20 -107.57 151.26 25.85 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.796 0.808 . . . . 0.0 110.696 -176.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.549 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -130.71 125.88 35.06 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.33 -173.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.8 tp -73.89 83.2 1.69 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.1 t -68.59 111.08 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -76.74 117.56 18.48 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.485 ' CZ3' HG11 ' A' ' 7' ' ' VAL . 26.6 m95 -90.46 121.1 32.12 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 176.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -70.43 -37.75 74.45 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -161.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.04 -10.99 84.21 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 116.523 -0.308 . . . . 0.0 113.268 177.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -108.43 148.99 38.75 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.618 1.167 . . . . 0.0 109.165 -177.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.9 159.65 50.68 Favored 'Trans proline' 0 CA--C 1.559 1.742 0 C-N-CA 122.092 1.861 . . . . 0.0 111.141 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.93 -16.22 48.15 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.966 2.444 . . . . 0.0 113.449 -176.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.488 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -72.25 -31.22 65.61 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.169 0.588 . . . . 0.0 111.694 173.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -88.65 9.74 23.12 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.526 0.73 . . . . 0.0 111.802 177.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.7 m -75.33 132.39 40.94 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.7 p -121.4 168.25 11.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.621 0.768 . . . . 0.0 111.059 -172.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -97.39 95.18 7.5 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.253 0.621 . . . . 0.0 110.997 -175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -96.96 122.88 55.31 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 123.645 0.778 . . . . 0.0 109.327 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.699 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 59.4 Cg_endo -69.03 171.24 14.0 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.085 1.857 . . . . 0.0 112.291 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -27.17 44.66 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.143 0.977 . . . . 0.0 111.774 174.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.591 ' HB2' ' HZ3' ' A' ' 19' ' ' LYS . 32.6 tt0 -57.87 -34.9 70.25 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.47 1.508 . . . . 0.0 111.293 175.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -98.64 -19.76 17.36 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.187 0.995 . . . . 0.0 111.511 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.641 HG21 HD21 ' A' ' 47' ' ' LEU . 51.2 mm -71.35 114.42 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 123.024 0.53 . . . . 0.0 109.974 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.1 mt -83.65 -50.49 8.14 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.552 0.691 . . . . 0.0 110.14 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -93.39 133.14 28.83 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.525 -166.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.26 -38.62 8.63 Favored 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.625 2.217 . . . . 0.0 112.201 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 47.6 mtm180 -69.82 -17.18 63.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.316 1.046 . . . . 0.0 111.119 -176.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.641 HD21 HG21 ' A' ' 42' ' ' ILE . 19.6 tp -59.21 -48.73 80.53 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 123.901 0.88 . . . . 0.0 111.142 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 80.7 t -84.46 -38.73 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.509 0.724 . . . . 0.0 110.675 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.492 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 57.7 mtt -64.94 -32.12 73.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.348 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.94 82.31 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.88 0.472 . . . . 0.0 109.862 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -58.84 -38.19 78.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.495 1.118 . . . . 0.0 111.718 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -97.98 -5.75 33.52 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 70.83 19.41 5.86 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.873 1.269 . . . . 0.0 112.739 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.49 6.44 37.73 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.761 0.824 . . . . 0.0 111.202 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -69.06 -26.2 64.84 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 168.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.007 170.944 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -97.43 104.79 16.84 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 7.8 t -104.27 137.53 42.04 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -73.85 114.98 12.76 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.457 ' O ' HG21 ' A' ' 7' ' ' VAL . 4.8 pm0 -54.13 143.49 22.33 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 124.359 1.037 . . . . 0.0 110.107 168.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 23.8 m -146.99 153.25 39.84 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.105 0.478 . . . . 0.0 111.903 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.07 148.6 42.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.863 1.265 . . . . 0.0 108.858 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -82.31 134.23 35.26 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.427 ' HG2' ' CZ2' ' A' ' 26' ' ' TRP . . . . . . . . 0 N--CA 1.475 0.822 0 CA-C-N 118.16 0.437 . . . . 0.0 111.981 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 17.6 t -72.21 83.57 1.03 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.725 0.774 . . . . 0.0 109.749 -178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 7.2 t -97.96 -7.44 30.05 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 114.42 -1.264 . . . . 0.0 110.074 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.98 -72.14 2.89 Favored Glycine 0 C--N 1.355 1.585 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.244 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 70.19 -154.32 52.52 Favored Glycine 0 C--N 1.347 1.191 0 CA-C-N 115.8 -0.2 . . . . 0.0 112.775 -178.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.528 ' HB2' ' HZ3' ' B' ' 14' ' ' LYS . 10.3 mtmp? -84.38 116.03 22.83 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 174.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 O-C-N 123.835 0.709 . . . . 0.0 110.016 -176.453 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.399 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -105.75 -55.36 2.34 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.436 0.695 . . . . 0.0 111.238 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.494 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.6 mp0 -74.47 102.38 4.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.544 -170.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.15 126.84 52.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 123.775 0.83 . . . . 0.0 109.362 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.494 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 38.7 m-85 -131.0 152.74 49.99 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.297 0.639 . . . . 0.0 110.583 -177.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.15 107.72 1.65 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.311 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 20.3 m -90.85 155.88 3.05 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.314 1.046 . . . . 0.0 110.742 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -83.22 -74.01 0.38 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 161.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.6 m -161.4 -177.57 6.07 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.325 1.05 . . . . 0.0 109.628 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.6 mm -76.33 114.49 16.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 172.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.0 -51.48 38.85 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 123.343 0.657 . . . . 0.0 109.369 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -139.28 155.82 47.48 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.792 0.837 . . . . 0.0 110.355 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -146.12 134.33 21.69 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.093 0.957 . . . . 0.0 109.071 -175.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.42 HH21 ' HB2' ' A' ' 16' ' ' ARG . 7.2 ptm180 -163.21 -174.55 3.87 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.708 1.203 . . . . 0.0 109.465 -173.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -136.66 139.73 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.541 0.736 . . . . 0.0 109.18 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.42 ' HB2' HH21 ' A' ' 14' ' ' ARG . 22.3 tpt180 -141.72 132.24 25.34 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt 59.49 26.12 15.02 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.599 1.16 . . . . 0.0 112.102 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.05 23.71 73.71 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.414 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -125.68 120.87 31.87 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.641 0.776 . . . . 0.0 109.288 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 28.1 t -73.88 112.96 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.293 0.637 . . . . 0.0 110.348 -174.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -96.86 147.87 23.51 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.493 0.717 . . . . 0.0 110.604 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.416 ' HB2' ' HE1' ' A' ' 41' ' ' HIS . 90.9 m-85 -132.4 112.35 12.09 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.989 0.916 . . . . 0.0 109.735 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.98 101.0 3.1 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 164.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.779 HG23 ' HE2' ' A' ' 41' ' ' HIS . 88.3 t -93.36 123.61 45.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-O 121.054 0.454 . . . . 0.0 110.321 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -83.98 107.76 16.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.821 172.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.423 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 9.1 m95 -83.19 119.05 24.06 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 174.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -69.17 -28.33 66.32 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.269 0.486 . . . . 0.0 111.816 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.39 -23.18 77.66 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.595 -0.275 . . . . 0.0 113.283 175.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 15.0 m95 -107.97 139.37 20.6 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.211 1.004 . . . . 0.0 109.54 -174.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -62.31 156.36 51.57 Favored 'Trans proline' 0 CA--C 1.563 1.964 0 C-N-CA 122.469 2.113 . . . . 0.0 111.86 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.79 -26.48 17.83 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.92 3.08 . . . . 0.0 115.427 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -67.44 -14.29 62.8 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -111.27 18.55 19.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.984 0.914 . . . . 0.0 111.692 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 p -68.69 123.18 20.2 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.0 p -121.28 167.15 13.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.272 0.629 . . . . 0.0 111.588 -172.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -111.16 121.73 46.06 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.204 1.002 . . . . 0.0 109.394 -173.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.461 ' HG2' ' HA ' ' B' ' 9' ' ' M3L . 7.2 mp0 -129.54 146.44 61.08 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -75.76 174.79 12.22 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.127 1.885 . . . . 0.0 112.701 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 10.8 pt-20 -49.58 -28.28 5.49 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 126.308 1.843 . . . . 0.0 114.613 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.76 -33.7 61.59 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.881 1.272 . . . . 0.0 112.44 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.779 ' HE2' HG23 ' A' ' 24' ' ' VAL . 3.4 p-80 -81.67 -18.83 43.17 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -168.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.7 mm -72.87 113.57 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.95 0.5 . . . . 0.0 109.681 -176.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -88.38 -33.56 17.88 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.98 0.419 . . . . 0.0 110.634 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.442 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 13.6 t70 -119.69 130.64 24.74 Favored Pre-proline 0 N--CA 1.48 1.043 0 C-N-CA 123.822 0.849 . . . . 0.0 110.709 -174.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.95 -36.08 40.48 Favored 'Trans proline' 0 C--N 1.381 2.271 0 C-N-CA 123.066 2.511 . . . . 0.0 113.008 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.401 ' HB2' HE21 ' B' ' 5' ' ' GLN . 95.0 mtt180 -65.37 -23.55 67.01 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.06 0.544 . . . . 0.0 111.05 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 34.6 tp -56.7 -52.37 65.21 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.652 0.781 . . . . 0.0 111.202 173.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.7 t -71.83 -51.86 29.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.846 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 23.1 mmt -62.09 -28.46 69.63 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.409 -1.269 . . . . 0.0 112.667 -172.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.87 -44.79 92.01 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 121.289 0.566 . . . . 0.0 111.002 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -72.11 -36.85 69.55 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.324 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -68.38 -35.31 77.52 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.441 0.296 . . . . 0.0 111.185 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.634 ' HG3' ' HD3' ' A' ' 54' ' ' LYS . 17.9 pt-20 -79.1 -37.12 39.53 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.363 0.265 . . . . 0.0 110.813 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.634 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 3.8 mppt? -89.33 -163.48 1.0 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.374 0.67 . . . . 0.0 109.268 170.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -144.22 131.71 21.0 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.916 0.486 . . . . 0.0 110.018 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 CA--C 1.559 1.295 0 C-N-CA 125.829 1.652 . . . . 0.0 112.367 176.839 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -87.17 91.1 8.6 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.271 0.629 . . . . 0.0 110.949 177.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 31.3 m 64.38 104.81 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.815 1.246 . . . . 0.0 111.868 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -160.08 81.55 0.7 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.679 0.792 . . . . 0.0 109.047 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.442 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 26.6 mp0 52.16 23.79 2.47 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.128 0.971 . . . . 0.0 112.629 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -65.47 145.04 56.62 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 123.695 0.798 . . . . 0.0 111.59 -172.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.453 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -137.72 116.69 12.43 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.143 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 41.6 mtm180 -75.59 153.9 37.05 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.493 175.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.461 ' HA ' ' HG2' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.476 0.83 0 O-C-N 121.512 -0.743 . . . . 0.0 110.143 174.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.9 t -63.71 89.95 0.05 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.028 0.931 . . . . 0.0 111.417 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 73.4 p -132.61 163.0 29.87 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.059 0.943 . . . . 0.0 110.136 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.04 -38.2 0.6 Allowed Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.874 -0.491 . . . . 0.0 111.874 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 156.62 -54.03 0.41 Allowed Glycine 0 C--N 1.339 0.717 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -139.38 146.92 40.78 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 0.0 110.219 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 166.785 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 CA-C-O 120.109 -0.273 . . . . 0.0 112.798 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -87.27 -178.34 6.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.02 0.528 . . . . 0.0 110.712 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -88.37 90.46 8.41 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 122.889 0.476 . . . . 0.0 111.31 -168.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' B' ' 8' ' ' ARG . 33.4 m -132.07 142.42 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 123.683 0.793 . . . . 0.0 109.821 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.421 ' CD1' ' HE3' ' B' ' 9' ' ' M3L . 33.9 m-85 -135.53 160.29 38.93 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.044 0.938 . . . . 0.0 110.218 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.73 114.81 4.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.528 0.731 . . . . 0.0 109.927 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.6 m -80.02 153.0 4.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.187 0.518 . . . . 0.0 110.698 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.526 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 37.3 tt0 -94.19 -62.33 1.36 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.58 -172.79 2.0 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.528 1.531 . . . . 0.0 108.559 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 mm -91.92 139.45 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 164.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -50.28 4.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.457 0.703 . . . . 0.0 109.916 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -137.55 171.26 14.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.385 0.674 . . . . 0.0 110.603 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.72 134.2 15.39 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -173.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -155.67 -178.0 6.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.987 0.915 . . . . 0.0 110.047 -174.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.97 139.57 33.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 108.805 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -149.83 108.97 3.92 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.134 0.973 . . . . 0.0 108.844 -170.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm 59.99 32.36 21.07 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.243 1.017 . . . . 0.0 111.242 -177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.66 -17.83 56.77 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 115.27 -0.877 . . . . 0.0 113.55 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.88 111.95 21.98 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.043 0.537 . . . . 0.0 110.481 -177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.09 110.48 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 177.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -103.61 148.47 25.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.456 1.102 . . . . 0.0 109.833 -172.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -128.77 123.75 33.73 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -71.7 83.12 0.87 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -65.74 105.93 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.6 112.78 14.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 37.0 m95 -83.89 147.48 27.49 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 177.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 87.9 tttt -62.77 -53.86 47.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.714 0.806 . . . . 0.0 112.33 -166.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.57 1.12 83.67 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 54.5 m95 -116.86 134.99 22.9 Favored Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 123.218 0.607 . . . . 0.0 110.812 -171.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.99 167.68 25.35 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 123.276 2.651 . . . . 0.0 112.712 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -51.45 -28.63 28.49 Favored 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 123.855 3.037 . . . . 0.0 115.34 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -72.73 -28.4 62.63 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.494 0.318 . . . . 0.0 111.318 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -102.86 11.27 37.71 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.49 0.716 . . . . 0.0 111.069 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.436 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.7 m -86.97 137.34 32.44 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 167.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.491 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 25.3 p -110.94 139.22 46.47 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.366 0.666 . . . . 0.0 110.918 -169.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.81 76.32 5.3 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.726 0.811 . . . . 0.0 110.031 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.491 ' HG2' ' HG1' ' A' ' 35' ' ' THR . 75.9 mm-40 -91.48 122.37 66.02 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 123.55 0.74 . . . . 0.0 109.218 -178.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -68.76 174.98 7.82 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.732 2.288 . . . . 0.0 112.95 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.69 -15.58 30.43 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.77 1.228 . . . . 0.0 112.268 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -55.35 -42.97 74.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.734 1.214 . . . . 0.0 110.922 173.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -105.13 -9.56 17.7 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.765 -171.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.577 HG22 HD22 ' A' ' 47' ' ' LEU . 50.4 mm -71.92 112.24 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.549 HD13 ' HB ' ' B' ' 6' ' ' THR . 35.6 mt -71.07 -21.73 62.2 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -172.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -143.55 128.09 9.53 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 122.825 0.45 . . . . 0.0 110.198 -169.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.48 -35.11 98.89 Favored 'Trans proline' 0 C--N 1.38 2.19 0 C-N-CA 122.79 2.327 . . . . 0.0 112.91 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -67.57 -20.29 65.37 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.693 0.397 . . . . 0.0 111.839 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.577 HD22 HG22 ' A' ' 42' ' ' ILE . 24.0 tp -57.39 -42.78 82.89 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.054 0.388 . . . . 0.0 110.423 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 48.8 t -87.81 -46.74 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.663 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtt -63.7 -46.93 83.24 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.764 0.825 . . . . 0.0 112.53 -172.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.58 -33.44 75.61 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 123.642 0.589 . . . . 0.0 110.683 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.36 -48.47 81.62 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.507 0.504 . . . . 0.0 110.445 169.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' VAL . 46.2 mt-10 -71.71 -7.73 49.81 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -173.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -69.22 -26.18 64.68 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.987 0.515 . . . . 0.0 111.411 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.53 ' HE2' ' HB3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -158.65 153.92 25.6 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.897 0.479 . . . . 0.0 110.379 -175.548 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -77.64 83.21 4.03 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.299 0.571 . . . . 0.0 110.091 176.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.53 ' HB3' ' HE2' ' A' ' 54' ' ' LYS . 9.6 tp10 . . . . . 0 CA--C 1.548 0.893 0 C-N-CA 124.618 1.167 . . . . 0.0 107.962 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 110.478 -0.193 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -82.93 -5.56 59.1 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.478 0.711 . . . . 0.0 111.3 174.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.2 t -80.66 121.33 25.73 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.388 0.675 . . . . 0.0 110.691 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -127.09 115.89 19.85 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.433 1.093 . . . . 0.0 108.171 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.517 ' HG3' ' HB2' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -126.27 169.25 13.08 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.692 0.797 . . . . 0.0 111.401 -175.104 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.549 ' HB ' HD13 ' A' ' 43' ' ' LEU . 19.0 m -148.86 162.08 40.56 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.899 1.28 . . . . 0.0 108.629 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.74 150.52 47.65 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.56 ' HA ' HG12 ' A' ' 4' ' ' VAL . 12.0 mmm-85 -95.98 119.96 35.4 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.421 ' HE3' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.242 0.662 0 CA-C-N 118.066 0.394 . . . . 0.0 110.126 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 32.6 t -66.87 84.56 0.12 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 124.005 0.816 . . . . 0.0 109.453 175.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -84.69 145.13 28.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.323 -177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.17 168.4 28.07 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.297 -176.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.9 76.65 0.22 Allowed Glycine 0 C--N 1.34 0.769 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -87.48 124.74 33.77 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.42 0.688 . . . . 0.0 110.752 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.183 0 C-N-CA 124.263 1.025 . . . . 0.0 109.084 -179.061 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.386 0 N-CA-C 112.386 -0.286 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.27 162.42 41.18 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.592 1.157 . . . . 0.0 108.383 179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -142.72 131.27 22.46 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-O 121.07 0.462 . . . . 0.0 110.862 173.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.1 m -99.82 152.3 4.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.386 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -131.19 143.94 50.97 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.859 0.463 . . . . 0.0 110.172 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.19 110.21 4.46 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.175 175.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.468 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 18.5 m -97.13 154.56 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.768 0.427 . . . . 0.0 111.295 -172.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.434 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 36.1 tt0 -81.08 -69.83 0.58 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 170.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.9 m -166.21 -177.6 4.2 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.836 1.254 . . . . 0.0 109.487 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.437 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.9 mm -76.61 142.46 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 167.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.2 -46.69 4.36 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -143.04 165.07 28.38 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.489 1.116 . . . . 0.0 109.928 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -153.69 128.67 9.58 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.783 0.833 . . . . 0.0 108.775 -169.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -155.85 -174.3 4.9 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.218 1.007 . . . . 0.0 109.467 -179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -135.59 129.81 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.2 ttp85 -133.74 119.39 19.23 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.151 0.98 . . . . 0.0 109.157 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HB2' ' HZ3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER 62.86 27.76 16.13 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.403 1.081 . . . . 0.0 111.52 177.023 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.16 10.87 79.65 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.442 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 111.99 23.23 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.544 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 70.6 t -70.93 109.88 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -96.62 145.17 25.98 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.432 0.634 . . . . 0.0 110.095 -171.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.437 ' HB3' HD12 ' A' ' 10' ' ' ILE . 96.5 m-85 -127.21 111.49 14.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.589 -1.187 . . . . 0.0 107.869 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 tp -66.61 81.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 167.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.521 HG22 ' HE2' ' A' ' 41' ' ' HIS . 95.6 t -77.37 116.15 20.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -78.05 111.2 13.71 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 170.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.713 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 5.6 m95 -85.3 140.53 30.75 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 4.3 tppp? -58.0 -57.36 13.14 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -168.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.44 1.39 88.87 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.924 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.713 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 61.8 m95 -115.15 128.2 26.15 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.421 0.689 . . . . 0.0 109.918 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.72 175.67 6.92 Favored 'Trans proline' 0 CA--C 1.572 2.416 0 C-N-CA 123.32 2.68 . . . . 0.0 112.905 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -65.11 -13.36 39.37 Favored 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.607 2.204 . . . . 0.0 114.614 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -79.99 -8.72 59.5 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 122.187 -0.321 . . . . 0.0 111.423 173.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -114.9 -8.74 12.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.982 0.913 . . . . 0.0 111.778 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.6 p -64.25 117.02 6.59 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 169.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.5 p -122.87 148.2 45.7 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.958 0.409 . . . . 0.0 111.745 -169.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.74 87.46 4.64 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.646 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -102.51 133.74 20.34 Favored Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.25 166.57 26.5 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.236 2.624 . . . . 0.0 114.135 -171.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 12.4 pt-20 -49.58 -29.82 7.65 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.469 1.907 . . . . 0.0 114.785 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.24 -45.49 91.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.723 0.809 . . . . 0.0 111.55 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.521 ' HE2' HG22 ' A' ' 24' ' ' VAL . 2.1 p-80 -62.74 -17.22 60.51 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -172.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.69 111.69 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.315 0.646 . . . . 0.0 109.825 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.542 HD21 ' HG2' ' B' ' 8' ' ' ARG . 53.8 mt -81.8 -15.25 54.81 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 120.908 0.385 . . . . 0.0 111.453 -176.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -144.87 119.7 5.8 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 123.431 0.692 . . . . 0.0 109.662 -164.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.22 -34.19 79.19 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 122.584 2.189 . . . . 0.0 112.269 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.493 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.9 mtt85 -65.77 -20.11 66.14 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.174 0.99 . . . . 0.0 110.774 -173.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.1 tp -59.47 -52.03 67.34 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.444 1.098 . . . . 0.0 111.272 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 39.4 t -78.85 -35.0 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.299 0.639 . . . . 0.0 109.915 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.493 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.6 mmt -68.5 -28.83 67.36 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.526 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.9 -30.56 56.23 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 122.882 0.473 . . . . 0.0 111.328 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -61.03 -50.53 72.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.138 0.575 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -87.17 -11.75 48.98 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.809 0.844 . . . . 0.0 111.53 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 61.06 37.56 17.79 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.75 1.22 . . . . 0.0 111.006 -177.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -68.83 108.7 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.089 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.69 -9.1 45.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.853 0.861 . . . . 0.0 111.14 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 123.749 0.82 . . . . 0.0 109.574 -176.945 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 120.724 0.297 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 140.34 40.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.809 0.844 . . . . 0.0 109.752 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 42.2 p -70.82 153.21 42.94 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.514 0.509 . . . . 0.0 110.421 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -83.19 90.12 7.05 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.461 HE21 ' HB2' ' A' ' 46' ' ' ARG . 19.2 mp0 -64.3 98.01 0.21 Allowed 'General case' 0 C--N 1.348 0.541 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 163.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -139.93 162.31 35.48 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 124.338 1.055 . . . . 0.0 109.813 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.483 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -148.78 141.66 24.71 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.831 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.542 ' HG2' HD21 ' A' ' 43' ' ' LEU . 19.5 mmt85 -69.85 179.05 2.37 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.906 0.883 . . . . 0.0 111.849 177.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.799 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.236 160.228 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.7 t -57.85 -35.09 70.44 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.206 0.602 . . . . 0.0 110.759 173.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m 61.58 18.23 9.3 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 124.87 1.268 . . . . 0.0 110.706 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 -97.85 2.26 Favored Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.014 -1.235 . . . . 0.0 110.014 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.58 97.45 0.07 OUTLIER Glycine 0 C--N 1.35 1.337 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 63.23 20.93 12.56 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.452 1.101 . . . . 0.0 111.525 -172.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 C-N-CA 124.39 1.076 . . . . 0.0 108.32 179.67 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.63 0 N-CA-C 112.298 -0.321 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.524 ' HA ' HG23 ' B' ' 11' ' ' THR . 46.9 mt-10 -77.97 74.66 4.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.764 0.793 . . . . 0.0 109.659 176.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.447 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 85.5 mt-30 -88.41 117.87 27.64 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.012 -171.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.5 m -112.0 123.85 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.771 0.828 . . . . 0.0 109.152 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.447 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 21.8 m-85 -124.79 162.78 23.54 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.641 0.776 . . . . 0.0 109.588 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.87 112.78 4.47 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.334 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.509 HG22 HD12 ' A' ' 47' ' ' LEU . 32.7 m -74.55 154.34 6.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.283 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.7 tp10 -89.24 -64.96 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 166.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.2 m -165.01 175.2 9.68 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.827 1.251 . . . . 0.0 108.685 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.501 HD11 ' HG ' ' A' ' 47' ' ' LEU . 41.3 mm -78.95 117.71 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 162.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -72.46 -56.49 5.33 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.1 mttm -132.76 161.74 33.29 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.411 0.684 . . . . 0.0 110.956 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -146.54 136.55 23.46 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.414 1.085 . . . . 0.0 108.4 -176.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -159.79 177.55 10.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.045 0.538 . . . . 0.0 110.303 -173.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.448 HG21 HG23 ' A' ' 20' ' ' VAL . 22.2 t -130.15 118.27 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 169.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.497 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 13.8 tpt85 -146.12 137.9 24.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.354 1.062 . . . . 0.0 108.895 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.497 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mtmt 64.99 25.05 12.68 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.278 1.031 . . . . 0.0 111.095 -178.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.05 4.83 84.14 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.876 -0.602 . . . . 0.0 113.411 -175.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -116.49 130.82 56.96 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.963 0.905 . . . . 0.0 110.312 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.448 HG23 HG21 ' A' ' 15' ' ' VAL . 46.3 t -79.23 108.29 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 39.0 mt-10 -101.16 147.26 26.45 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.151 0.581 . . . . 0.0 110.356 -171.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -129.04 123.13 31.53 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.058 0.943 . . . . 0.0 108.902 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.6 tp -76.12 88.07 3.02 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 167.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.504 HG21 ' HE2' ' A' ' 41' ' ' HIS . 91.9 t -78.13 111.3 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.082 0.553 . . . . 0.0 110.116 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.562 ' HZ1' ' HA ' ' A' ' 31' ' ' PRO . 4.9 tmtm? -83.18 132.4 35.07 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -106.36 135.2 48.26 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 19.9 ttmm -56.27 -59.97 4.18 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -165.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.27 17.98 25.69 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.437 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -122.92 134.7 25.2 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.211 1.004 . . . . 0.0 109.542 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -56.27 155.85 23.24 Favored 'Trans proline' 0 CA--C 1.567 2.125 0 C-N-CA 123.464 2.776 . . . . 0.0 113.378 -177.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.562 ' HA ' ' HZ1' ' A' ' 25' ' ' LYS . 87.5 Cg_exo -47.34 -38.27 26.25 Favored 'Trans proline' 0 C--N 1.383 2.376 0 C-N-CA 124.357 3.371 . . . . 0.0 116.029 -176.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -81.8 -9.05 59.73 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -91.95 10.25 29.67 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.71 0.804 . . . . 0.0 111.53 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.8 m -71.2 137.9 49.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 169.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 p -119.78 147.52 44.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.863 0.465 . . . . 0.0 111.43 -171.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -94.43 119.59 33.38 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.962 0.905 . . . . 0.0 110.213 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -138.73 147.53 54.87 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 123.204 0.602 . . . . 0.0 109.631 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 16.0 Cg_exo -65.31 177.73 2.44 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 123.251 2.634 . . . . 0.0 113.12 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.54 -15.88 59.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.794 0.838 . . . . 0.0 112.587 -178.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.82 -23.76 66.75 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.847 1.259 . . . . 0.0 112.766 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' B' ' 7' ' ' ALA . 1.6 p-80 -89.37 -7.26 55.61 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.1 mm -71.08 112.93 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.559 0.744 . . . . 0.0 110.423 -175.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.6 mt -90.28 -10.82 42.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.013 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -150.69 131.01 6.97 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.637 -174.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -61.17 -33.0 91.47 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.174 2.583 . . . . 0.0 113.049 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.585 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 39.0 mmt180 -65.32 -15.73 62.84 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.381 0.672 . . . . 0.0 112.092 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.58 ' HB2' ' HB3' ' B' ' 5' ' ' GLN . 14.1 tp -64.57 -48.25 75.69 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.043 0.537 . . . . 0.0 110.737 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.32 -32.71 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.301 0.64 . . . . 0.0 110.251 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.585 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 52.7 mtt -61.57 -48.96 78.58 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.189 0.995 . . . . 0.0 111.396 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.74 -28.46 69.9 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.392 0.677 . . . . 0.0 111.475 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.87 -55.62 16.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.701 0.401 . . . . 0.0 110.984 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.93 -27.9 35.98 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.714 -170.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -116.08 40.09 2.91 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.6 1.16 . . . . 0.0 109.86 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.452 ' HG2' ' HB3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -61.94 166.23 4.75 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 114.361 -1.29 . . . . 0.0 113.114 177.315 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -18.99 65.71 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.471 1.108 . . . . 0.0 112.233 -178.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.452 ' HB3' ' HG2' ' A' ' 54' ' ' LYS . 14.4 tp10 . . . . . 0 CA--C 1.555 1.165 0 C-N-CA 124.103 0.961 . . . . 0.0 110.374 174.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -93.12 -32.5 14.41 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.676 0.79 . . . . 0.0 110.442 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 44.8 p 61.2 11.03 3.28 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 126.143 1.777 . . . . 0.0 114.159 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -81.67 -4.83 57.24 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.1 0.96 . . . . 0.0 110.276 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.58 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.8 mp0 -70.69 72.27 0.52 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.425 1.49 . . . . 0.0 110.408 178.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 p -82.42 172.37 13.13 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 -170.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.554 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -162.8 133.6 4.79 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.859 -169.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -72.67 121.4 19.73 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.834 0.454 . . . . 0.0 110.075 175.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.004 0 CA-C-N 118.033 0.379 . . . . 0.0 111.432 172.376 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 16.8 p -59.05 95.19 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 171.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.524 HG23 ' HA ' ' A' ' 2' ' ' GLU . 71.0 p -61.27 -34.5 75.27 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.558 1.143 . . . . 0.0 112.031 -169.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -122.1 58.59 0.59 Allowed Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 171.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.57 141.59 37.13 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 112.007 -0.437 . . . . 0.0 112.007 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.81 114.61 10.61 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.287 0.635 . . . . 0.0 110.643 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.17 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 174.509 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -79.78 83.2 5.76 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.34 0.656 . . . . 0.0 109.731 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -77.96 99.34 6.01 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.702 -174.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -97.92 153.38 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.987 0.915 . . . . 0.0 111.351 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.508 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 54.6 m-85 -137.46 156.77 47.78 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.568 1.147 . . . . 0.0 108.152 171.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.467 ' HB1' ' HE2' ' A' ' 27' ' ' LYS . . . -68.81 125.67 27.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.35 0.66 . . . . 0.0 110.522 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.14 154.06 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.377 0.671 . . . . 0.0 110.25 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 12.7 tp10 -83.82 -69.52 0.63 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.4 m -158.86 -161.14 0.93 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.977 1.311 . . . . 0.0 108.16 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.483 HG22 ' HB3' ' A' ' 22' ' ' TYR . 48.1 mm -90.71 121.7 41.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.025 0.53 . . . . 0.0 109.98 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -77.41 -55.03 5.73 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.097 0.959 . . . . 0.0 109.836 -179.572 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -135.51 171.64 14.15 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.214 0.606 . . . . 0.0 110.552 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -155.81 143.31 19.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.023 0.529 . . . . 0.0 110.587 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -165.56 163.1 19.41 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.373 1.069 . . . . 0.0 108.556 175.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.557 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 14.0 p -101.31 137.82 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 168.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -153.39 127.99 9.37 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.292 0.637 . . . . 0.0 109.552 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.7 tptt 65.52 26.26 11.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.748 1.219 . . . . 0.0 111.077 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.82 3.71 90.44 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.524 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -119.27 119.16 33.24 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.759 0.824 . . . . 0.0 109.598 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.557 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 34.6 t -71.01 107.49 2.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 176.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.542 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 9.1 pt-20 -100.16 137.92 37.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.993 0.917 . . . . 0.0 109.72 -177.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.483 ' HB3' HG22 ' A' ' 10' ' ' ILE . 42.4 m-85 -116.75 123.19 46.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.115 -1.402 . . . . 0.0 107.838 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 tp -67.25 88.18 0.18 Allowed 'General case' 0 C--N 1.347 0.475 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 165.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.86 126.37 31.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 28.1 tptp -77.49 99.86 5.83 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.508 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 62.0 m95 -75.08 105.02 5.89 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 173.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 65.5 pttt -70.31 -20.01 63.04 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -162.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.25 -13.06 79.85 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 123.002 0.189 . . . . 0.0 112.653 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -125.17 152.65 71.13 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 109.735 -170.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.03 165.1 33.49 Favored 'Trans proline' 0 CA--C 1.567 2.127 0 C-N-CA 122.455 2.103 . . . . 0.0 111.603 172.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.79 -20.64 69.92 Favored 'Trans proline' 0 C--N 1.391 2.804 0 C-N-CA 123.214 2.609 . . . . 0.0 113.793 -174.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -80.2 -29.16 38.57 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.391 0.277 . . . . 0.0 111.6 176.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -87.69 -6.49 58.2 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.044 0.538 . . . . 0.0 110.745 173.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.1 m -78.55 157.91 28.67 Favored 'General case' 0 C--N 1.353 0.754 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.437 ' OG1' HM22 ' B' ' 9' ' ' M3L . 3.2 m -139.37 155.18 47.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 120.612 0.244 . . . . 0.0 111.601 -164.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -87.27 92.25 9.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.2 1.0 . . . . 0.0 111.129 -175.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' B' ' 8' ' ' ARG . 5.3 mp0 -104.78 121.49 46.66 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 124.243 1.017 . . . . 0.0 109.976 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.542 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 35.5 Cg_exo -61.44 174.42 2.1 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.933 2.422 . . . . 0.0 114.121 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.33 -13.81 61.11 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.546 -175.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -25.58 53.15 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.233 0.213 . . . . 0.0 111.377 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -80.04 -25.07 40.3 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.533 0.733 . . . . 0.0 111.4 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.635 HG22 HD22 ' A' ' 47' ' ' LEU . 50.4 mm -68.37 127.82 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.045 0.938 . . . . 0.0 110.46 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' B' ' 6' ' ' THR . 56.9 mt -77.15 -64.09 1.22 Allowed 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.106 0.479 . . . . 0.0 110.956 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -100.65 133.5 21.18 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.498 -172.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -59.56 -30.82 93.33 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 123.219 2.613 . . . . 0.0 113.343 -175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.443 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 67.7 mtp180 -69.48 -16.04 63.38 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.58 0.752 . . . . 0.0 112.045 -176.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.635 HD22 HG22 ' A' ' 42' ' ' ILE . 20.2 tp -59.93 -43.57 94.87 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 120.968 0.413 . . . . 0.0 110.642 172.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 77.3 t -82.74 -48.89 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.417 175.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.443 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -65.66 -31.69 72.84 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.645 1.178 . . . . 0.0 113.303 -169.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.25 -37.46 69.12 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.829 0.347 . . . . 0.0 110.884 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -66.13 -39.16 89.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.507 0.723 . . . . 0.0 110.344 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -76.06 -19.52 58.52 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.683 0.793 . . . . 0.0 111.836 178.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 63.2 19.62 11.78 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.531 1.133 . . . . 0.0 110.851 -169.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.74 115.24 27.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.584 1.154 . . . . 0.0 110.547 -172.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -77.61 111.28 13.21 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 CA--C 1.568 1.656 0 C-N-CA 126.67 1.988 . . . . 0.0 113.844 -173.262 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -84.5 94.82 8.64 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.581 0.753 . . . . 0.0 110.079 -172.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 70.0 p 47.13 54.69 9.03 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.878 1.671 . . . . 0.0 114.186 173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -93.0 85.81 5.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 173.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.499 ' HB3' HD11 ' A' ' 47' ' ' LEU . 84.6 mm-40 -69.29 129.81 40.83 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.553 ' HB ' HD11 ' A' ' 43' ' ' LEU . 30.9 m -150.75 157.72 43.29 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 124.003 0.921 . . . . 0.0 109.03 -173.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.81 161.95 36.74 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.953 0.901 . . . . 0.0 109.702 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 37' ' ' GLU . 5.2 mpt_? -86.94 149.78 24.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 168.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.437 HM22 ' OG1' ' A' ' 35' ' ' THR . . . . . . . . 0 N--CA 1.474 0.764 0 C-N-CA 122.806 0.442 . . . . 0.0 110.752 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 14.5 p -80.33 61.76 4.23 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.666 0.787 . . . . 0.0 110.476 175.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 7.2 t -70.41 -25.92 63.44 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.727 0.811 . . . . 0.0 111.266 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -115.89 27.68 8.13 Favored Glycine 0 C--N 1.346 1.119 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 172.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.29 143.29 18.05 Favored Glycine 0 C--N 1.349 1.29 0 C-N-CA 123.229 0.443 . . . . 0.0 112.291 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.631 ' HZ2' ' HB2' ' B' ' 14' ' ' LYS . 0.1 OUTLIER -96.18 154.53 17.2 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.95 0.9 . . . . 0.0 109.696 -179.53 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.881 0 C-N-CA 123.818 0.847 . . . . 0.0 108.722 178.486 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 CA-C-O 120.035 -0.314 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -91.97 130.86 37.63 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.318 0.647 . . . . 0.0 111.127 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -77.7 89.72 3.98 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.65 0.78 . . . . 0.0 109.424 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.554 HG13 ' HG2' ' B' ' 8' ' ' ARG . 31.1 m -101.89 137.76 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.583 0.753 . . . . 0.0 109.788 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -134.21 159.94 39.39 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 124.062 0.945 . . . . 0.0 109.29 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.59 144.3 32.49 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.951 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.408 HG23 HD11 ' A' ' 47' ' ' LEU . 22.7 m -91.09 154.81 3.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.099 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.5 tt0 -82.88 -57.89 3.11 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 160.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -163.52 177.65 8.65 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.917 1.287 . . . . 0.0 109.351 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.1 mm -81.2 114.94 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 162.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -54.84 18.3 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.75 0.82 . . . . 0.0 109.453 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -143.59 169.82 17.0 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.8 0.84 . . . . 0.0 111.092 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -149.23 135.41 19.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.53 1.132 . . . . 0.0 108.888 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -160.74 175.51 12.53 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.556 0.743 . . . . 0.0 109.16 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -117.94 114.84 46.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 CA-C-O 121.511 0.672 . . . . 0.0 109.573 170.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -105.9 97.67 7.46 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 124.878 1.271 . . . . 0.0 109.678 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 62.16 41.88 10.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 172.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.13 -15.11 63.67 Favored Glycine 0 N--CA 1.472 1.097 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.301 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm -88.4 109.93 20.41 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.435 0.694 . . . . 0.0 109.2 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.29 106.14 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.585 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 77.5 mt-10 -114.09 150.19 34.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.718 -168.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -122.6 116.7 24.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.438 -1.71 . . . . 0.0 108.2 -176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.0 tp -69.22 104.27 2.16 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.415 HG21 ' NE2' ' A' ' 41' ' ' HIS . 14.8 t -94.08 108.68 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -170.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -76.89 120.73 22.43 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.1 m95 -93.24 153.26 18.7 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.12 0.568 . . . . 0.0 110.433 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -70.98 -9.27 57.69 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -163.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -149.47 24.17 1.21 Allowed Glycine 0 N--CA 1.474 1.221 0 CA-C-N 117.937 0.335 . . . . 0.0 112.342 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 51.0 m95 -123.4 136.9 27.65 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 124.131 0.972 . . . . 0.0 108.484 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -59.13 159.76 21.12 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 122.941 2.427 . . . . 0.0 112.959 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -53.39 -30.2 51.78 Favored 'Trans proline' 0 C--N 1.382 2.297 0 C-N-CA 123.393 2.729 . . . . 0.0 114.278 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.6 ' HB2' ' HZ1' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -79.1 -15.02 58.76 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 178.491 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -99.85 17.24 21.3 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.598 0.759 . . . . 0.0 111.698 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -81.1 141.19 34.54 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.2 p -110.19 130.13 55.6 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -169.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.58 96.46 1.97 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.838 0.455 . . . . 0.0 109.986 170.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -123.47 131.58 24.29 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.155 0.982 . . . . 0.0 109.92 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.585 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 84.4 Cg_endo -70.59 170.63 17.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.131 2.554 . . . . 0.0 113.672 -175.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -53.39 -17.11 1.67 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.847 1.259 . . . . 0.0 114.316 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.29 -39.24 89.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.933 0.893 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.455 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 9.3 p-80 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.806 0.442 . . . . 0.0 111.996 -177.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.8 mm -67.85 116.01 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 124.324 1.049 . . . . 0.0 110.515 -175.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.2 mt -99.22 8.55 44.7 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.954 0.502 . . . . 0.0 111.348 -176.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -150.08 118.98 3.7 Favored Pre-proline 0 N--CA 1.483 1.199 0 C-N-CA 123.581 0.753 . . . . 0.0 109.714 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.47 -36.8 52.55 Favored 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 122.954 2.436 . . . . 0.0 112.576 -177.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -65.12 -22.33 66.92 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 125.221 1.408 . . . . 0.0 111.469 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.408 HD11 HG23 ' A' ' 7' ' ' VAL . 16.9 tp -59.56 -52.17 66.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.816 0.846 . . . . 0.0 111.375 174.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.88 -42.23 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.569 0.699 . . . . 0.0 111.02 178.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -74.46 -26.81 60.27 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.649 -171.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.93 -29.05 55.47 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.126 0.571 . . . . 0.0 111.11 175.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -59.44 -45.75 90.7 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.529 0.731 . . . . 0.0 109.953 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.87 -16.95 49.02 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.581 178.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 69.06 5.93 5.35 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.177 1.391 . . . . 0.0 113.259 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -80.52 152.83 28.48 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 80.38 -15.69 0.72 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 125.831 1.653 . . . . 0.0 112.161 -174.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 C--O 1.251 1.173 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.382 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -82.36 72.6 9.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 23.6 m -91.91 148.54 22.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.19 0.996 . . . . 0.0 109.095 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -69.48 82.88 0.4 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.736 0.779 . . . . 0.0 110.563 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -108.84 80.81 1.37 Allowed 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.4 p -76.06 148.39 38.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.268 -176.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.455 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.94 132.3 16.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.824 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.554 ' HG2' HG13 ' A' ' 4' ' ' VAL . 23.4 mtm180 -84.44 170.41 13.57 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.207 0.603 . . . . 0.0 111.074 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.448 HM13 ' CE2' ' A' ' 29' ' ' TRP . . . . . . . . 0 N--CA 1.479 1.009 0 C-N-CA 123.719 0.808 . . . . 0.0 108.838 171.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 79.3 p -161.48 -174.38 4.24 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.463 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -150.31 159.48 44.42 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.881 0.873 . . . . 0.0 109.485 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.75 -60.32 0.87 Allowed Glycine 0 C--N 1.343 0.936 0 CA-C-O 120.001 -0.333 . . . . 0.0 112.977 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 58.36 35.38 78.71 Favored Glycine 0 C--N 1.352 1.419 0 O-C-N 123.748 0.323 . . . . 0.0 112.971 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -87.99 135.51 33.38 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.95 0.9 . . . . 0.0 111.083 -172.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.31 0 C-N-CA 123.975 0.91 . . . . 0.0 108.68 172.931 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.528 0 N-CA-C 111.296 -0.721 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -98.27 98.47 9.73 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.161 0.984 . . . . 0.0 109.926 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -82.19 138.66 34.63 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.551 0.74 . . . . 0.0 111.112 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.5 m -85.5 138.62 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.688 0.795 . . . . 0.0 110.756 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -131.12 157.61 42.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.764 0.826 . . . . 0.0 109.771 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.17 107.22 10.6 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 123.578 0.751 . . . . 0.0 109.333 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.91 154.2 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.832 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.546 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.1 tt0 -93.44 -52.94 4.27 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.409 0.683 . . . . 0.0 109.668 177.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -161.93 168.21 23.3 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.67 1.188 . . . . 0.0 109.839 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.447 HD11 HG21 ' A' ' 24' ' ' VAL . 32.4 mm -77.28 115.07 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 162.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.416 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -69.86 -58.61 3.67 Favored 'General case' 0 CA--C 1.556 1.177 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.082 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.416 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.0 mtpp -139.08 171.48 14.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.978 0.911 . . . . 0.0 110.994 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -154.32 133.05 12.2 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.651 1.18 . . . . 0.0 108.569 -171.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -160.23 179.57 8.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.981 0.913 . . . . 0.0 110.074 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 8.9 p -129.81 138.04 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.461 0.704 . . . . 0.0 109.966 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -138.74 100.68 4.13 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.503 1.121 . . . . 0.0 108.904 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 60.59 36.86 19.71 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.127 0.971 . . . . 0.0 111.43 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.58 -10.77 73.52 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.2 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -99.8 108.84 21.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.218 0.607 . . . . 0.0 110.18 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 59.9 t -76.95 112.31 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.608 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -96.27 139.3 32.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.669 0.788 . . . . 0.0 109.835 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.422 ' HB2' ' HE2' ' A' ' 41' ' ' HIS . 41.0 m-85 -118.72 110.18 16.96 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.7 tp -69.84 105.37 2.76 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 167.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.541 HG22 ' HE1' ' A' ' 41' ' ' HIS . 76.2 t -101.05 118.88 48.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -77.39 115.66 17.34 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 171.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 11.1 m95 -90.38 144.44 25.81 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.546 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 30.5 ttmt -64.23 -53.85 42.75 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -166.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.83 1.46 86.28 Favored Glycine 0 CA--C 1.533 1.172 0 N-CA-C 113.798 0.279 . . . . 0.0 113.798 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.6 m95 -114.81 135.8 22.44 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.741 0.816 . . . . 0.0 109.322 -177.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -64.51 160.7 38.41 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 C-N-CA 122.467 2.111 . . . . 0.0 112.038 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.52 -22.25 21.22 Favored 'Trans proline' 0 C--N 1.384 2.416 0 C-N-CA 123.531 2.821 . . . . 0.0 114.48 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -77.39 -35.78 54.03 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.507 0.323 . . . . 0.0 111.489 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -82.9 0.38 44.58 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.071 0.549 . . . . 0.0 111.242 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.1 m -70.67 140.83 51.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.43 0.692 . . . . 0.0 109.669 171.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -132.06 156.49 46.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.267 0.627 . . . . 0.0 111.811 -167.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -95.41 112.28 24.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.528 1.131 . . . . 0.0 109.351 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' B' ' 9' ' ' M3L . 18.3 mp0 -116.95 144.39 33.41 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.612 0.765 . . . . 0.0 109.435 172.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.82 160.5 49.42 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 123.081 2.521 . . . . 0.0 112.171 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -50.33 -28.59 8.17 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 125.921 1.688 . . . . 0.0 114.629 -167.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.734 ' HG2' HH22 ' B' ' 8' ' ' ARG . 39.4 tt0 -64.1 -30.11 71.2 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.587 0.755 . . . . 0.0 112.224 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.541 ' HE1' HG22 ' A' ' 24' ' ' VAL . 1.1 p80 -64.1 -22.52 66.97 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.48 114.24 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.18 0.592 . . . . 0.0 109.53 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.3 mt -85.04 -63.88 1.25 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -77.75 118.37 71.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.003 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.79 -25.61 39.38 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.501 2.134 . . . . 0.0 111.961 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -70.98 -16.69 62.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.667 0.787 . . . . 0.0 111.03 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' B' ' 5' ' ' GLN . 14.5 tp -60.48 -52.92 63.16 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.964 . . . . 0.0 111.255 172.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.2 t -76.35 -38.65 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.274 0.63 . . . . 0.0 109.764 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtm -67.95 -27.99 67.08 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.229 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.24 -43.85 49.3 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.976 0.353 . . . . 0.0 110.051 175.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -56.19 -54.81 40.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.056 0.542 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -79.21 -7.79 58.52 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.971 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 60.01 32.35 21.04 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.768 1.227 . . . . 0.0 110.783 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.506 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -76.92 84.14 3.47 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.045 -175.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -85.03 78.02 9.98 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 CA--C 1.551 1.007 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.468 -171.829 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.372 0.13 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -72.15 97.59 1.97 Allowed 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 111.415 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 62.5 m -64.42 -44.21 91.93 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.342 173.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 55.05 78.45 0.18 Allowed 'General case' 0 C--O 1.244 0.776 0 C-N-CA 125.026 1.33 . . . . 0.0 110.982 -172.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.487 ' HB2' HD11 ' A' ' 47' ' ' LEU . 21.7 pt20 -59.36 114.34 2.62 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 113.77 -1.559 . . . . 0.0 109.514 169.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 11.2 m -127.11 141.65 51.71 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.279 0.632 . . . . 0.0 110.37 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.84 148.76 31.23 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.136 0.974 . . . . 0.0 109.819 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.734 HH22 ' HG2' ' A' ' 40' ' ' GLU . 70.3 mtm-85 -86.35 176.08 8.08 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.218 0.607 . . . . 0.0 110.783 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.54 ' HA ' ' HG2' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.477 0.885 0 C-N-CA 122.752 0.421 . . . . 0.0 110.84 169.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 37.2 t -78.55 159.23 28.26 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 12.5 t -141.09 157.14 45.71 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 123.775 0.83 . . . . 0.0 109.269 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.76 -44.35 3.24 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 111.859 -0.497 . . . . 0.0 111.859 -175.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.35 158.25 34.02 Favored Glycine 0 C--N 1.35 1.359 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 -177.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -153.72 158.7 41.39 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.127 0.571 . . . . 0.0 111.375 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.555 1.143 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.735 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.941 0 N-CA-C 112.029 -0.429 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -126.76 44.49 2.88 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.827 0.851 . . . . 0.0 110.458 -172.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.487 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.3 mp0 -73.91 124.24 25.79 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.171 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 m -115.72 125.61 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.948 0.899 . . . . 0.0 110.439 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 83.4 m-85 -122.36 155.89 35.08 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.011 0.524 . . . . 0.0 110.499 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.45 110.32 3.08 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.072 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.498 HG23 HD13 ' A' ' 47' ' ' LEU . 16.4 m -84.16 154.66 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.54 0.736 . . . . 0.0 110.391 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.456 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.2 tt0 -91.23 -65.64 1.0 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 171.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.3 m -163.44 175.51 10.7 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.329 1.452 . . . . 0.0 108.251 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.509 HD11 ' HB3' ' A' ' 22' ' ' TYR . 34.7 mm -74.78 119.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 165.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -74.19 -45.04 50.93 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -156.38 159.69 38.98 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.237 0.615 . . . . 0.0 109.928 -175.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -149.91 147.55 28.05 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.328 0.651 . . . . 0.0 109.905 -172.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -168.2 -173.99 2.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.22 1.008 . . . . 0.0 109.323 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -126.56 123.13 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.737 0.815 . . . . 0.0 108.893 173.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -150.07 150.35 31.6 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.93 24.85 13.78 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.625 1.17 . . . . 0.0 111.128 -173.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.71 16.05 67.38 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-N 116.102 -0.499 . . . . 0.0 113.235 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -126.7 145.85 50.43 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.466 1.106 . . . . 0.0 109.219 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.18 112.5 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -96.08 140.67 30.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.406 0.683 . . . . 0.0 109.977 -175.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HB3' HD11 ' A' ' 10' ' ' ILE . 93.3 m-85 -125.97 109.8 12.87 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.993 0.917 . . . . 0.0 109.077 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.7 tp -68.87 89.44 0.4 Allowed 'General case' 0 C--N 1.344 0.355 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.637 HG23 ' HE2' ' A' ' 41' ' ' HIS . 89.9 t -85.93 115.98 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 122.85 0.46 . . . . 0.0 109.886 -174.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -79.23 111.38 15.41 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.3 m95 -83.41 130.01 35.02 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.9 ttpt -62.09 -51.23 68.77 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.08 8.78 59.5 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 123.204 0.315 . . . . 0.0 113.658 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 65.8 m95 -123.42 137.96 29.33 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.084 0.954 . . . . 0.0 109.338 -174.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.497 ' HG2' ' CD1' ' A' ' 33' ' ' TYR . 29.7 Cg_endo -63.87 153.7 74.13 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 122.946 2.431 . . . . 0.0 113.212 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -38.53 -47.95 2.55 Favored 'Trans proline' 0 C--N 1.389 2.707 1 C-N-CA 125.888 4.392 . . . . 0.0 117.293 -171.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -72.36 -17.58 61.82 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -171.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.497 ' CD1' ' HG2' ' A' ' 30' ' ' PRO . 76.8 m-85 -84.6 7.54 19.82 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.246 0.618 . . . . 0.0 111.961 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.6 p -68.49 124.24 23.03 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 167.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 p -112.33 142.15 45.19 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.158 0.583 . . . . 0.0 111.086 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -77.14 81.71 3.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.784 0.834 . . . . 0.0 109.17 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -94.08 127.51 44.69 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.174 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.43 175.84 9.52 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.425 2.083 . . . . 0.0 113.263 -173.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.07 -34.2 9.27 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.794 1.637 . . . . 0.0 113.797 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -58.58 -30.02 66.86 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.737 1.215 . . . . 0.0 112.934 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.637 ' HE2' HG23 ' A' ' 24' ' ' VAL . 2.0 p-80 -84.48 -16.76 41.34 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -170.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.4 mm -67.31 123.37 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.065 0.546 . . . . 0.0 109.882 -176.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.517 HD23 ' HG2' ' B' ' 8' ' ' ARG . 30.0 mt -99.22 -44.82 6.11 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.822 0.344 . . . . 0.0 110.469 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 26.3 t70 -110.74 129.27 24.14 Favored Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.67 -176.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.26 -27.03 41.38 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 123.107 2.538 . . . . 0.0 113.571 -175.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.594 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 41.4 mmt180 -70.13 -15.68 63.0 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.947 0.499 . . . . 0.0 111.507 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.498 HD13 HG23 ' A' ' 7' ' ' VAL . 18.9 tp -58.91 -44.43 91.25 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.549 0.74 . . . . 0.0 110.368 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -89.13 -35.9 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.316 0.646 . . . . 0.0 110.664 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.594 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 75.8 mmm -68.76 -33.94 74.74 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.028 0.931 . . . . 0.0 112.243 -175.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.07 -28.42 63.32 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.582 0.353 . . . . 0.0 110.497 175.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -75.24 -45.42 40.26 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.242 1.017 . . . . 0.0 111.65 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -84.44 -55.75 3.98 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.855 0.462 . . . . 0.0 111.059 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -92.34 81.11 4.93 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -69.16 145.43 53.29 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.423 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -73.82 -11.5 60.4 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.146 174.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 124.78 1.232 . . . . 0.0 109.305 168.944 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.789 0 CA-C-O 120.642 0.258 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -77.58 -4.96 48.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.195 0.598 . . . . 0.0 112.525 -177.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.4 t -67.1 89.28 0.18 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 122.518 1.152 . . . . 0.0 109.275 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.463 ' HG3' HG22 ' B' ' 6' ' ' THR . 17.9 tppt? -149.78 126.22 10.86 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.337 -172.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.572 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.4 mp0 -72.18 103.23 3.27 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.463 HG22 ' HG3' ' B' ' 4' ' ' LYS . 5.1 p -122.98 162.91 21.41 Favored 'General case' 0 C--O 1.248 1.021 0 C-N-CA 124.079 0.952 . . . . 0.0 110.22 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . . . -157.19 126.69 6.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.408 -172.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.517 ' HG2' HD23 ' A' ' 43' ' ' LEU . 14.8 mmt85 -68.51 157.56 35.7 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 172.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.404 ' HE3' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.473 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 109.654 170.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 33.2 t -68.88 87.97 0.37 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.373 1.069 . . . . 0.0 108.748 173.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 10.5 m -77.6 81.47 4.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.065 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.27 -76.58 1.45 Allowed Glycine 0 C--N 1.347 1.181 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.713 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.8 104.0 0.66 Allowed Glycine 0 C--N 1.351 1.383 0 C-N-CA 123.473 0.558 . . . . 0.0 113.281 -177.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.67 -174.91 2.97 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.676 1.19 . . . . 0.0 109.719 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.283 0 C-N-CA 123.099 0.559 . . . . 0.0 110.222 179.189 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -87.02 -14.66 40.96 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 110.845 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -71.84 104.89 3.59 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.309 1.044 . . . . 0.0 111.707 -168.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.78 140.1 18.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.126 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -134.29 141.7 47.04 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 171.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.13 113.19 4.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.294 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.447 HG23 ' O ' ' B' ' 5' ' ' GLN . 15.9 m -90.07 154.55 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.019 0.527 . . . . 0.0 111.132 -173.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' HG3' ' HZ1' ' A' ' 27' ' ' LYS . 37.9 tt0 -84.18 -68.98 0.67 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -159.4 -179.6 8.09 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mm -83.0 121.36 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -60.21 2.35 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.252 1.021 . . . . 0.0 108.54 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -137.67 169.82 17.13 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.956 0.902 . . . . 0.0 110.523 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -153.65 128.17 9.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.814 0.846 . . . . 0.0 109.083 -170.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -162.61 -173.74 3.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.222 1.009 . . . . 0.0 110.104 -176.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.38 143.89 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.148 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 4.1 ttm180 -147.98 115.07 6.16 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.108 0.963 . . . . 0.0 108.614 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 55.5 mtpt 63.84 32.43 13.39 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.159 0.984 . . . . 0.0 111.851 172.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.47 -15.15 63.01 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.261 -0.881 . . . . 0.0 113.021 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -96.58 110.68 23.04 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.689 0.796 . . . . 0.0 109.588 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.98 109.49 8.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -97.62 137.97 35.73 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 122.747 0.419 . . . . 0.0 110.32 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -115.51 110.22 18.95 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 167.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.1 tp -67.13 101.79 0.94 Allowed 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.448 HG22 ' CE1' ' A' ' 41' ' ' HIS . 71.9 t -97.42 122.62 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 122.221 0.209 . . . . 0.0 111.092 -172.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -78.57 119.46 21.87 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -89.0 140.55 29.32 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.97 0.908 . . . . 0.0 109.429 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.426 ' HZ1' ' HG3' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -62.0 -51.46 67.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.063 0.545 . . . . 0.0 112.399 -168.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.43 9.14 78.12 Favored Glycine 0 C--N 1.346 1.084 0 N-CA-C 114.071 0.388 . . . . 0.0 114.071 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.9 m95 -127.84 137.62 31.15 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -175.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -64.2 159.01 45.27 Favored 'Trans proline' 0 C--N 1.377 2.044 0 C-N-CA 122.608 2.205 . . . . 0.0 111.812 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -60.09 -11.73 16.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.61 2.873 . . . . 0.0 115.708 -171.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -80.32 -18.32 49.51 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 118.851 0.75 . . . . 0.0 111.323 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -88.91 2.22 54.13 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.739 0.815 . . . . 0.0 111.407 172.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 t -64.13 123.53 19.3 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.2 p -119.1 156.82 29.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.689 0.796 . . . . 0.0 110.912 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -95.17 116.21 28.43 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.785 0.834 . . . . 0.0 108.833 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -119.5 149.76 48.49 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 123.497 0.719 . . . . 0.0 109.381 171.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.16 149.56 81.89 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 121.943 1.762 . . . . 0.0 110.409 168.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -56.6 -16.38 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.522 1.129 . . . . 0.0 113.991 -168.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.63 -28.44 65.66 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.757 1.223 . . . . 0.0 112.477 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.448 ' CE1' HG22 ' A' ' 24' ' ' VAL . 1.2 p80 -72.9 -15.6 61.58 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.492 HG23 HG23 ' A' ' 48' ' ' VAL . 37.4 mm -69.89 120.37 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 123.599 0.759 . . . . 0.0 109.666 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.491 HD23 ' HG3' ' B' ' 8' ' ' ARG . 26.0 mt -86.58 -15.41 39.94 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.616 0.366 . . . . 0.0 111.344 -177.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -147.9 125.86 5.91 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.201 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -55.61 -31.74 80.45 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.785 2.99 . . . . 0.0 113.86 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.454 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.3 mmt180 -65.22 -16.8 63.93 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.3 tp -69.61 -48.42 60.15 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.182 0.593 . . . . 0.0 110.595 173.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.492 HG23 HG23 ' A' ' 42' ' ' ILE . 26.1 t -69.01 -39.47 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 CA-C-O 121.439 0.638 . . . . 0.0 109.903 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.454 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 93.5 mtp -69.81 -32.57 71.09 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 114.328 -1.305 . . . . 0.0 111.236 -176.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -28.62 69.84 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.357 0.663 . . . . 0.0 111.639 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -64.48 -55.31 21.55 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.486 0.714 . . . . 0.0 110.85 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -87.96 -45.79 9.93 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.357 0.663 . . . . 0.0 110.462 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -83.77 66.67 9.18 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.533 ' H ' ' HD3' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -69.57 152.15 45.12 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.528 -174.157 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 64.65 24.86 13.02 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.716 1.207 . . . . 0.0 111.694 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 124.003 0.921 . . . . 0.0 109.514 176.409 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -77.78 95.12 4.61 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 10.0 t -162.04 168.6 22.45 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 124.149 0.98 . . . . 0.0 109.528 -175.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -118.88 72.1 0.87 Allowed 'General case' 0 C--O 1.247 0.935 0 C-N-CA 123.605 0.762 . . . . 0.0 109.499 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 7' ' ' VAL . 5.2 pm0 -65.15 123.05 18.5 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 169.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -136.43 165.74 25.11 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 123.881 0.872 . . . . 0.0 110.796 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.424 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -153.44 140.08 18.89 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.671 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.491 ' HG3' HD23 ' A' ' 43' ' ' LEU . 70.0 mtm180 -79.52 145.28 33.28 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.02 0.528 . . . . 0.0 109.673 174.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.23 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.478 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 36.2 t -74.64 177.67 5.94 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.573 1.149 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 15.1 t -131.95 14.79 4.77 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.86 172.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.79 32.49 61.21 Favored Glycine 0 C--N 1.355 1.633 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.408 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.82 -80.93 1.11 Allowed Glycine 0 C--N 1.343 0.946 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -164.22 125.71 2.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.091 0.557 . . . . 0.0 110.233 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 174.816 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' B' ' 9' ' ' M3L . 5.3 mp0 -84.67 75.35 10.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.259 1.024 . . . . 0.0 109.187 -174.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -112.28 140.59 46.87 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.73 0.812 . . . . 0.0 110.195 -172.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.5 m -82.73 138.07 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 122.989 0.516 . . . . 0.0 110.58 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -135.06 146.1 48.61 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 123.832 0.853 . . . . 0.0 108.947 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.65 120.61 13.76 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.742 0.817 . . . . 0.0 109.55 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 9.5 m -95.78 153.48 3.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 C-N-CA 123.03 0.532 . . . . 0.0 110.183 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.507 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 36.0 tt0 -86.57 -65.59 1.0 Allowed 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 170.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -158.79 -179.27 7.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.373 1.069 . . . . 0.0 109.168 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -88.93 121.88 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 163.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -62.4 1.65 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -125.15 171.58 10.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.434 0.694 . . . . 0.0 111.476 -176.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -155.27 144.44 20.94 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 109.68 -173.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -168.56 -175.98 2.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.259 1.024 . . . . 0.0 109.41 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.14 127.9 20.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 52.2 ttt-85 -140.69 125.81 18.49 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG2' ' HG2' ' A' ' 16' ' ' ARG . 72.7 mmtt 64.44 25.16 13.3 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.48 1.112 . . . . 0.0 111.507 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.65 74.53 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.156 -0.474 . . . . 0.0 113.204 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -89.89 110.6 21.54 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.021 0.928 . . . . 0.0 108.905 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 t -77.88 105.47 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.71 137.3 36.82 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.264 0.626 . . . . 0.0 110.019 -169.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -126.51 112.57 15.72 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.9 tp -69.2 86.91 0.4 Allowed 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.34 112.6 6.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 C-N-CA 123.199 0.6 . . . . 0.0 109.656 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -77.55 110.53 12.43 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 171.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.3 m95 -82.71 153.71 25.19 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 39.6 ttmt -70.8 -60.84 2.02 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.138 0.575 . . . . 0.0 112.33 -167.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.07 6.83 77.84 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 116.252 -0.431 . . . . 0.0 113.13 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.9 m95 -118.06 134.64 23.31 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.223 1.009 . . . . 0.0 109.072 -177.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.83 171.4 12.29 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.795 2.33 . . . . 0.0 111.858 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.5 -14.53 44.89 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 122.78 2.32 . . . . 0.0 113.664 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -83.28 -6.72 59.57 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.303 0.641 . . . . 0.0 112.227 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -114.94 13.22 17.0 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.031 0.932 . . . . 0.0 110.613 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.2 m -82.37 133.42 35.22 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 27.3 p -116.16 143.39 45.56 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.912 0.885 . . . . 0.0 110.494 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -71.09 82.12 0.69 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 170.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -101.33 109.48 58.92 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.551 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.45 162.95 31.59 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.537 2.158 . . . . 0.0 113.336 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -54.05 -26.55 27.2 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.178 1.391 . . . . 0.0 112.165 174.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -56.27 -31.88 64.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.275 1.43 . . . . 0.0 111.628 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -113.36 -10.93 13.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.887 0.875 . . . . 0.0 112.097 -174.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.626 HG23 HD22 ' A' ' 47' ' ' LEU . 44.3 mm -65.61 141.63 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 170.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.552 HD12 ' HB ' ' B' ' 6' ' ' THR . 3.9 pp -113.38 -12.25 13.03 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.812 1.187 . . . . 0.0 112.214 178.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -101.26 117.02 63.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 173.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.12 -38.0 93.31 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.438 2.092 . . . . 0.0 110.323 166.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.66 ' HG3' HG22 ' B' ' 3' ' ' THR . 21.2 mmm180 -62.3 -23.25 66.63 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.194 0.998 . . . . 0.0 113.292 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.626 HD22 HG23 ' A' ' 42' ' ' ILE . 19.5 tp -66.52 -52.52 44.93 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 118.26 0.482 . . . . 0.0 110.674 178.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.435 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 90.7 t -72.94 -37.61 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.034 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 61.4 mtt -60.5 -38.83 85.59 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.705 0.802 . . . . 0.0 111.268 176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.06 -33.96 76.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.577 0.751 . . . . 0.0 110.581 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -69.06 -41.27 77.82 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.344 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.0 mm-40 -64.86 -39.6 93.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.74 0.416 . . . . 0.0 110.845 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -92.68 9.87 33.03 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.601 0.76 . . . . 0.0 111.735 -177.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.523 ' HG2' ' HG3' ' A' ' 56' ' ' GLU . 18.8 ttpp -56.65 119.57 6.35 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.154 0.981 . . . . 0.0 111.706 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -75.2 89.57 2.53 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.222 1.009 . . . . 0.0 111.025 -177.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.523 ' HG3' ' HG2' ' A' ' 54' ' ' LYS . 58.8 mt-10 . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 59.04 27.83 16.89 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.419 1.088 . . . . 0.0 110.891 -174.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' THR . . . . . 0.66 HG22 ' HG3' ' A' ' 46' ' ' ARG . 31.4 p -106.98 79.29 1.31 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.856 1.262 . . . . 0.0 109.366 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.16 -32.33 30.05 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.777 0.831 . . . . 0.0 110.488 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 61.49 69.55 0.65 Allowed 'General case' 0 CA--C 1.551 1.018 0 O-C-N 124.702 1.251 . . . . 0.0 109.01 -174.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.552 ' HB ' HD12 ' A' ' 43' ' ' LEU . 27.2 m -150.72 145.15 25.61 Favored 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 123.99 0.916 . . . . 0.0 111.278 -169.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -131.36 149.66 52.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.082 0.953 . . . . 0.0 109.615 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.435 ' HG3' HD22 ' A' ' 43' ' ' LEU . 78.9 mtm180 -93.71 126.52 38.93 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.075 0.95 . . . . 0.0 108.921 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.537 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--O 1.222 -0.39 0 O-C-N 123.395 0.434 . . . . 0.0 110.07 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.8 t -66.44 -28.1 68.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.814 0.446 . . . . 0.0 110.269 170.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 29.9 p 52.47 46.22 27.1 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.151 1.38 . . . . 0.0 111.751 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.78 91.35 0.26 Allowed Glycine 0 C--N 1.348 1.229 0 CA-C-N 114.858 -1.064 . . . . 0.0 112.394 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.26 -42.68 99.23 Favored Glycine 0 C--N 1.354 1.56 0 O-C-N 123.757 0.328 . . . . 0.0 112.814 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -86.04 103.27 14.57 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 172.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.952 0 C-N-CA 123.62 0.768 . . . . 0.0 109.092 179.627 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -66.57 90.66 0.17 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.156 0.583 . . . . 0.0 111.051 -176.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -78.78 84.43 4.85 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.739 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.53 143.25 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.842 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.465 ' CD1' ' HE3' ' B' ' 9' ' ' M3L . 26.0 m-85 -139.93 150.59 44.73 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.063 0.945 . . . . 0.0 109.702 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.91 131.12 45.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.925 176.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.5 m -116.46 154.27 18.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.129 0.571 . . . . 0.0 111.383 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 26.3 tt0 -85.14 -58.79 2.54 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.441 1.096 . . . . 0.0 108.503 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.8 m -174.95 -178.65 1.27 Allowed 'General case' 0 C--O 1.243 0.751 0 C-N-CA 126.525 1.93 . . . . 0.0 108.025 178.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.521 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 45.0 mm -78.18 124.5 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -61.14 1.9 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.64 0.776 . . . . 0.0 109.123 176.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -133.99 156.64 47.82 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.856 0.863 . . . . 0.0 110.148 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -145.68 141.72 28.35 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.425 0.69 . . . . 0.0 109.466 -176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -165.21 -173.17 2.77 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.398 1.079 . . . . 0.0 109.357 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -135.39 119.33 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.408 0.623 . . . . 0.0 110.359 175.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -102.21 97.62 7.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.187 0.995 . . . . 0.0 108.731 173.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp 56.58 52.75 9.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.357 1.063 . . . . 0.0 113.096 168.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 -3.19 85.85 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.731 -0.668 . . . . 0.0 113.561 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -111.89 111.76 22.94 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 36.9 t -77.77 112.94 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -96.8 138.06 34.93 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.13 0.972 . . . . 0.0 109.876 -171.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.478 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.0 m-85 -127.74 110.14 12.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.162 0.985 . . . . 0.0 109.246 -178.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.5 tp -69.68 101.69 1.72 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.935 -1.505 . . . . 0.0 106.935 165.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.522 HG22 ' HE2' ' A' ' 41' ' ' HIS . 25.6 t -93.21 117.72 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 122.495 0.318 . . . . 0.0 110.383 -171.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -80.13 110.9 15.97 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 56.9 m95 -85.55 77.67 9.82 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.131 0.491 . . . . 0.0 109.895 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 85.2 tttt 52.56 -91.15 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.907 1.683 . . . . 0.0 113.022 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -121.61 14.17 9.27 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 122.877 0.275 . . . . 0.0 113.037 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 25.4 m95 -70.84 129.17 90.01 Favored Pre-proline 0 N--CA 1.473 0.698 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 171.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.42 146.4 62.76 Favored 'Trans proline' 0 C--N 1.379 2.15 0 C-N-CA 122.866 2.377 . . . . 0.0 112.068 -175.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -44.74 -29.08 3.25 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 124.623 3.549 . . . . 0.0 116.865 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -74.37 -7.46 52.95 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -104.98 0.98 28.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.998 0.919 . . . . 0.0 111.745 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.6 p -71.94 123.29 22.4 Favored 'General case' 0 C--N 1.351 0.666 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 171.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.0 p -114.42 139.3 49.61 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 0.0 111.934 -169.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -77.49 86.3 3.85 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.328 1.051 . . . . 0.0 110.06 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -101.52 137.78 19.7 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.012 0.925 . . . . 0.0 109.916 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.11 161.41 26.4 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 122.208 1.938 . . . . 0.0 112.634 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -38.37 -33.08 0.09 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 127.291 2.236 . . . . 0.0 116.196 -171.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.78 -30.03 70.14 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.05 0.94 . . . . 0.0 112.635 -172.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.522 ' HE2' HG22 ' A' ' 24' ' ' VAL . 6.5 p-80 -71.77 -12.54 61.35 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.8 mm -71.54 128.95 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.086 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.557 HD12 ' HB ' ' B' ' 6' ' ' THR . 3.6 pp -108.52 -4.49 17.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 119.818 1.19 . . . . 0.0 112.853 176.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.437 ' HB3' HD11 ' A' ' 43' ' ' LEU . 4.9 p-10 -139.58 153.99 70.92 Favored Pre-proline 0 N--CA 1.481 1.081 0 C-N-CA 122.482 0.313 . . . . 0.0 111.484 -171.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -67.66 -40.15 10.58 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.226 1.951 . . . . 0.0 112.793 176.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -61.25 -28.22 69.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.853 0.861 . . . . 0.0 113.116 -165.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.43 -52.46 32.47 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.451 0.7 . . . . 0.0 112.496 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.11 -36.15 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-O 121.43 0.633 . . . . 0.0 110.391 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mtp -74.53 -28.34 60.92 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.319 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 54' ' ' LYS . . . -64.48 -37.81 88.84 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.378 0.671 . . . . 0.0 110.995 177.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.521 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.9 t80 -54.52 -51.79 64.04 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.348 1.059 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -65.59 -43.63 89.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.929 -174.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -105.22 52.66 0.73 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.481 -177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.6 OUTLIER -120.81 115.16 22.73 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.827 0.851 . . . . 0.0 110.645 175.685 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.94 79.1 9.33 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 169.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . 0.689 ' HB1' ' HB2' ' B' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -87.33 -41.8 13.36 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.642 0.777 . . . . 0.0 111.066 -175.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 21.6 p -93.09 -31.78 14.7 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.043 0.937 . . . . 0.0 111.589 -179.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.689 ' HB2' ' HB1' ' B' ' 1' ' ' ALA . 74.2 mmtt -72.46 104.31 3.76 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -73.27 101.9 3.52 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.557 ' HB ' HD12 ' A' ' 43' ' ' LEU . 28.4 m -149.33 153.2 37.1 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.288 1.042 . . . . 0.0 110.805 -167.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.501 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -142.96 150.05 39.18 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.554 -178.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 43' ' ' LEU . 2.2 mpt_? -86.54 157.54 19.73 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.465 ' HE3' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 170.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 16.8 p -54.14 101.9 0.05 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.626 0.77 . . . . 0.0 111.28 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.8 t -113.19 143.41 44.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.445 1.098 . . . . 0.0 111.262 -170.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.06 146.21 18.59 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.602 171.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 168.63 -175.37 43.22 Favored Glycine 0 C--N 1.343 0.945 0 N-CA-C 112.259 -0.336 . . . . 0.0 112.259 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.554 ' HB2' ' HZ3' ' B' ' 14' ' ' LYS . 5.2 ttmp? -155.25 127.0 7.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.089 0.555 . . . . 0.0 110.54 -177.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.251 0 C-N-CA 124.912 1.285 . . . . 0.0 108.646 169.537 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.963 0 CA-C-O 119.762 -0.465 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -125.69 146.23 49.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.645 0.778 . . . . 0.0 109.67 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -99.78 82.3 2.58 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.402 HG11 ' HG2' ' B' ' 8' ' ' ARG . 6.7 m -90.59 143.57 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.64 0.776 . . . . 0.0 110.503 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -139.61 138.18 35.96 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.643 0.777 . . . . 0.0 110.589 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.87 115.21 20.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 164.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.0 m -105.59 158.04 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.334 0.654 . . . . 0.0 111.576 -165.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.88 -56.14 8.86 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.773 0.67 . . . . 0.0 111.21 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -162.02 177.5 9.7 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.942 0.897 . . . . 0.0 110.225 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -83.83 119.61 33.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 157.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.477 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.7 tmt_? -71.42 -62.94 1.23 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.4 mttt -128.09 160.16 32.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.68 0.792 . . . . 0.0 110.61 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -146.34 140.23 26.25 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.815 1.246 . . . . 0.0 107.788 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -163.89 -175.57 4.14 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.127 0.571 . . . . 0.0 110.03 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.7 p -139.26 124.02 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.413 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 79.0 ttt180 -123.14 106.04 10.43 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.215 1.406 . . . . 0.0 108.569 -173.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HE2' ' HG2' ' A' ' 16' ' ' ARG . 37.3 mtmt 65.95 25.49 11.07 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.758 1.223 . . . . 0.0 111.702 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.43 -13.94 66.43 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.603 -0.271 . . . . 0.0 113.0 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -84.76 110.96 19.18 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.242 0.617 . . . . 0.0 110.275 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.519 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 41.1 t -73.2 111.57 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -107.58 144.43 34.62 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.435 0.694 . . . . 0.0 110.864 -171.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -130.2 113.92 15.05 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.042 0.937 . . . . 0.0 110.255 -175.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 34.2 tp -74.56 93.83 2.56 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 166.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.502 HG21 ' HE2' ' A' ' 41' ' ' HIS . 59.6 t -87.36 116.12 29.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 C-N-CA 122.69 0.396 . . . . 0.0 110.406 -173.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -74.92 113.68 12.5 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.156 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.532 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.9 m95 -84.54 132.97 34.46 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.011 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -81.97 110.62 17.39 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 123.475 0.485 . . . . 0.0 109.886 -172.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 113.16 -16.96 22.29 Favored Glycine 0 N--CA 1.473 1.108 0 O-C-N 123.724 0.64 . . . . 0.0 111.681 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.532 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 20.6 m95 -107.83 130.54 22.67 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 123.963 0.905 . . . . 0.0 108.901 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.43 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 23.8 Cg_endo -59.96 154.61 49.43 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.444 2.096 . . . . 0.0 112.599 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -51.22 -17.8 4.31 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 124.605 3.536 . . . . 0.0 116.166 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -79.96 -35.43 37.65 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.678 0.391 . . . . 0.0 111.138 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.43 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 41.9 m-85 -77.88 -11.36 59.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.468 0.707 . . . . 0.0 111.064 173.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.444 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.2 t -61.55 132.29 52.88 Favored 'General case' 0 C--N 1.358 0.972 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.1 p -127.72 164.14 22.78 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.075 0.55 . . . . 0.0 111.572 -170.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -100.16 116.59 32.54 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.39 1.076 . . . . 0.0 109.826 -172.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.41 153.37 72.29 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 168.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.59 -177.51 3.41 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.355 2.037 . . . . 0.0 114.214 -174.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 9.8 pt-20 -52.02 -31.43 29.78 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.267 1.827 . . . . 0.0 112.687 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.65 -45.99 92.02 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.721 1.208 . . . . 0.0 112.214 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.502 ' HE2' HG21 ' A' ' 24' ' ' VAL . 1.1 p-80 -75.52 -13.7 60.37 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -170.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.8 mm -66.87 104.84 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 175.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.561 HD11 ' HB ' ' B' ' 6' ' ' THR . 20.3 mt -90.39 -51.9 5.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.98 125.46 83.82 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.034 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.44 -37.52 13.14 Favored 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 122.901 2.401 . . . . 0.0 112.313 177.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -63.03 -21.76 66.38 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.764 0.826 . . . . 0.0 111.727 -177.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.1 -50.89 71.89 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.97 0.908 . . . . 0.0 111.618 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.482 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 46.8 t -80.24 -43.4 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.967 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.7 mtt -59.68 -45.38 92.26 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.301 1.04 . . . . 0.0 112.412 -175.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -27.27 63.33 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.218 0.607 . . . . 0.0 111.143 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.21 -37.54 78.12 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.616 0.366 . . . . 0.0 110.938 172.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.0 mm-40 -60.42 -60.35 3.94 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.082 0.239 . . . . 0.0 111.265 -175.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 60.38 7.16 1.22 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 124.777 1.231 . . . . 0.0 113.636 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -75.57 149.15 38.37 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 123.129 0.572 . . . . 0.0 111.127 -174.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -73.71 91.52 1.91 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.099 175.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.21 1.004 . . . . 0.0 110.865 -179.12 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 32.4 mmt180 -73.0 -46.23 53.41 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.378 0.671 . . . . 0.0 109.55 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 54.2 p -83.92 77.85 9.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.049 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -80.06 79.45 6.61 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.12 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -105.22 95.67 5.99 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.312 1.045 . . . . 0.0 108.869 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.561 ' HB ' HD11 ' A' ' 43' ' ' LEU . 10.8 p -78.99 119.91 22.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.691 -173.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.71 123.6 18.83 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.099 1.36 . . . . 0.0 108.523 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 41' ' ' HIS . 17.8 mtm-85 -93.55 119.95 33.22 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 119.1 -0.476 . . . . 0.0 109.934 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 121.281 0.563 . . . . 0.0 110.88 179.489 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.2 t -173.82 -168.78 0.44 Allowed 'General case' 0 C--O 1.245 0.823 0 CA-C-N 114.115 -1.402 . . . . 0.0 108.226 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.6 p -63.49 -36.37 83.53 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.793 0.806 . . . . 0.0 108.886 160.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.44 131.34 1.22 Allowed Glycine 0 C--N 1.342 0.9 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.539 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.97 -35.81 90.04 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -130.43 166.56 20.22 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.633 1.173 . . . . 0.0 109.112 175.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 C-N-CA 123.501 0.721 . . . . 0.0 109.377 179.266 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.196 0 N-CA-C 112.282 -0.327 . . . . 0.0 112.282 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.42 0.77 4.08 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.492 0.717 . . . . 0.0 110.927 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -78.17 82.56 4.48 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.513 0.725 . . . . 0.0 110.721 -169.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.93 127.34 38.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-O 121.041 0.448 . . . . 0.0 111.086 -177.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.26 162.98 20.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.838 0.855 . . . . 0.0 109.173 174.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.54 107.42 5.05 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.281 0.633 . . . . 0.0 110.491 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 9.6 m -75.93 154.09 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.382 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.52 -66.03 0.93 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 163.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.4 m -164.64 -162.34 0.64 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.156 1.782 . . . . 0.0 107.421 174.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.456 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -85.38 137.22 21.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 164.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.573 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.8 tmt_? -88.9 -54.3 4.2 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -137.17 163.94 29.67 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.503 0.721 . . . . 0.0 110.618 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -151.49 143.54 23.92 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.144 0.977 . . . . 0.0 108.483 -173.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -164.42 168.0 18.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.683 0.793 . . . . 0.0 110.179 -176.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.8 t -116.0 125.29 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -123.54 94.9 4.38 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.295 1.038 . . . . 0.0 108.701 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.58 39.15 27.9 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.322 1.049 . . . . 0.0 111.353 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.93 -18.27 57.02 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.371 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -90.9 108.08 19.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.979 0.512 . . . . 0.0 109.688 -177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.6 t -80.66 109.41 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 55.8 mt-10 -97.14 155.42 16.83 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.603 0.716 . . . . 0.0 110.864 -176.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.456 ' HB3' HD12 ' A' ' 10' ' ' ILE . 75.2 m-85 -134.65 109.81 8.88 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.102 177.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.15 87.73 0.11 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.429 HG22 ' HE2' ' A' ' 41' ' ' HIS . 63.1 t -74.24 118.75 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -174.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.573 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 22.6 tptm -80.19 124.84 29.15 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 36.9 m95 -103.89 134.89 46.43 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.09 -38.79 66.27 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -165.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.36 14.68 60.43 Favored Glycine 0 N--CA 1.474 1.172 0 CA-C-N 116.365 -0.38 . . . . 0.0 113.535 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 69.2 m95 -135.47 135.67 22.7 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 123.658 0.783 . . . . 0.0 110.003 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.99 164.75 21.05 Favored 'Trans proline' 0 CA--C 1.569 2.229 0 C-N-CA 122.971 2.447 . . . . 0.0 112.402 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.91 -13.47 27.32 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 123.793 2.996 . . . . 0.0 114.754 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.8 -23.62 63.36 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.696 0.399 . . . . 0.0 111.866 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -103.58 3.08 34.21 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.727 0.811 . . . . 0.0 112.294 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.4 p -71.21 129.62 39.37 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 169.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 p -118.75 128.27 54.33 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.094 0.558 . . . . 0.0 112.228 -165.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -71.18 101.52 2.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.517 0.727 . . . . 0.0 109.324 173.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -133.31 134.91 24.55 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.502 0.721 . . . . 0.0 109.059 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 68.7 Cg_endo -68.91 167.39 23.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.839 2.359 . . . . 0.0 113.831 -173.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.08 -21.85 0.8 Allowed 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 125.329 1.451 . . . . 0.0 114.59 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -54.73 -44.72 73.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.591 1.156 . . . . 0.0 111.53 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.429 ' HE2' HG22 ' A' ' 24' ' ' VAL . 1.3 p-80 -83.11 -5.64 59.19 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.224 -172.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.513 HG22 HG23 ' A' ' 48' ' ' VAL . 28.5 mm -80.28 121.19 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.584 HD12 ' HG3' ' B' ' 8' ' ' ARG . 5.5 mp -88.09 -47.98 8.08 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.044 0.538 . . . . 0.0 109.606 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -100.51 130.83 24.82 Favored Pre-proline 0 CA--C 1.549 0.928 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.581 -169.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.33 -35.29 24.45 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 122.699 2.266 . . . . 0.0 113.183 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.503 ' HB2' HE21 ' B' ' 5' ' ' GLN . 56.5 mmm-85 -69.42 -16.15 63.44 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.179 0.592 . . . . 0.0 111.351 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.53 -47.05 80.26 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.238 0.615 . . . . 0.0 110.461 173.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.513 HG23 HG22 ' A' ' 42' ' ' ILE . 67.5 t -73.58 -44.31 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.583 0.753 . . . . 0.0 110.577 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -67.1 -55.46 14.17 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.008 -171.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.26 -28.36 67.99 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.496 0.718 . . . . 0.0 112.558 -174.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -55.3 -49.92 70.9 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.915 0.886 . . . . 0.0 111.06 171.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -80.09 -31.29 39.27 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.748 0.819 . . . . 0.0 111.605 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 49' ' ' MET . 8.9 pt-20 -124.13 90.67 3.3 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.916 . . . . 0.0 109.037 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -73.89 164.8 26.16 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 122.321 1.058 . . . . 0.0 113.41 -174.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.79 167.99 10.45 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-N 113.209 -1.814 . . . . 0.0 107.556 165.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 . . . . . 0 N--CA 1.486 1.367 0 C-N-CA 124.888 1.275 . . . . 0.0 110.992 171.843 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 121.125 0.488 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -149.67 143.18 25.33 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.779 0.832 . . . . 0.0 109.412 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.5 m -65.97 115.18 5.77 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.452 0.701 . . . . 0.0 110.435 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -135.51 -155.05 0.61 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.674 1.19 . . . . 0.0 109.586 -176.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.503 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.9 mp0 -62.39 107.11 0.85 Allowed 'General case' 0 C--N 1.353 0.742 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 161.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.1 m -140.51 155.17 46.73 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 122.927 0.491 . . . . 0.0 110.122 -171.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.73 133.78 22.7 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.324 0.649 . . . . 0.0 111.365 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.584 ' HG3' HD12 ' A' ' 43' ' ' LEU . 94.7 mtt180 -79.38 118.42 21.27 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.844 0.858 . . . . 0.0 110.125 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.454 0 CA-C-N 118.884 0.765 . . . . 0.0 110.561 174.728 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 40.1 t -60.92 139.34 58.03 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 124.607 1.192 . . . . 0.0 109.694 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 22.3 m -61.1 -30.67 70.49 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.015 0.526 . . . . 0.0 110.482 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.46 32.12 65.09 Favored Glycine 0 C--N 1.352 1.454 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.113 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.31 76.66 1.45 Allowed Glycine 0 C--N 1.351 1.367 0 O-C-N 123.842 0.378 . . . . 0.0 112.169 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -168.69 146.8 4.03 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.435 1.094 . . . . 0.0 109.329 -178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.203 0 C-N-CA 123.577 0.751 . . . . 0.0 110.545 175.155 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 111.894 -0.483 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.464 ' HB3' ' HG3' ' B' ' 8' ' ' ARG . 2.7 mp0 -91.5 125.14 36.14 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.698 0.799 . . . . 0.0 109.313 -177.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -78.47 82.06 4.77 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.448 0.699 . . . . 0.0 109.696 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.467 HG13 HH11 ' B' ' 8' ' ' ARG . 35.2 m -97.06 127.58 49.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.963 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -130.15 148.53 52.0 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 124.088 0.955 . . . . 0.0 108.509 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.85 117.72 9.35 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.022 0.529 . . . . 0.0 109.627 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.445 HG12 ' CE3' ' A' ' 26' ' ' TRP . 11.2 m -99.64 150.79 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 123.171 0.588 . . . . 0.0 110.267 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.566 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 40.0 tt0 -73.62 -72.38 0.27 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -162.07 -176.42 5.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.141 1.377 . . . . 0.0 108.114 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.48 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.7 mm -71.3 124.49 27.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.466 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -76.97 -57.21 3.98 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.466 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.2 mttm -134.55 160.29 38.51 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.063 0.945 . . . . 0.0 110.421 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -145.61 134.49 22.47 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.91 0.884 . . . . 0.0 109.103 -166.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -167.24 176.58 6.66 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.213 0.605 . . . . 0.0 110.602 -178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -128.47 117.15 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -112.11 101.68 9.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.766 0.826 . . . . 0.0 109.299 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.5 tptp 52.99 53.12 12.54 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.61 1.164 . . . . 0.0 112.229 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.67 -17.06 58.68 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-N 115.324 -0.853 . . . . 0.0 114.066 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -91.82 118.75 30.99 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 174.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -83.49 102.49 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 172.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -105.93 138.59 41.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.979 0.512 . . . . 0.0 110.514 -167.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.48 ' HB3' HD12 ' A' ' 10' ' ' ILE . 22.2 m-85 -126.14 113.22 16.76 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.725 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.6 tp -64.62 100.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.975 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 164.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.458 HG21 ' CE1' ' A' ' 41' ' ' HIS . 95.3 t -100.69 129.22 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.27 109.89 19.82 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.125 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.445 ' CE3' HG12 ' A' ' 7' ' ' VAL . 27.1 m95 -83.64 106.79 15.64 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 63.4 pttt -69.26 -22.43 63.84 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -168.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.78 -36.89 92.83 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.561 0.538 . . . . 0.0 112.389 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -101.65 164.53 15.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.454 1.102 . . . . 0.0 109.48 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.69 152.64 64.68 Favored 'Trans proline' 0 CA--C 1.564 2.006 0 C-N-CA 121.612 1.541 . . . . 0.0 111.351 173.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -59.17 -8.82 7.01 Favored 'Trans proline' 0 C--N 1.388 2.639 0 C-N-CA 124.089 3.193 . . . . 0.0 115.775 -173.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -70.2 -12.72 61.79 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.05 0.386 . . . . 0.0 111.579 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -105.46 18.22 22.59 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.096 0.959 . . . . 0.0 111.286 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -68.76 116.98 9.88 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -109.81 140.48 43.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.293 0.637 . . . . 0.0 111.114 -174.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -75.46 87.33 2.61 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -102.59 127.94 29.2 Favored Pre-proline 0 CA--C 1.551 1.017 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.255 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.66 159.31 51.68 Favored 'Trans proline' 0 C--N 1.383 2.343 0 C-N-CA 123.235 2.623 . . . . 0.0 112.545 -178.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -58.95 -11.95 3.97 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -167.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.18 -33.57 69.39 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.307 1.043 . . . . 0.0 110.696 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.538 ' ND1' ' HB1' ' B' ' 7' ' ' ALA . 0.3 OUTLIER -79.76 -13.51 59.39 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -174.348 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mm -72.46 122.1 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.914 0.886 . . . . 0.0 110.515 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.7 mt -106.1 -0.92 24.34 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.773 0.429 . . . . 0.0 111.643 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -145.43 128.0 8.1 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 109.427 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -62.66 -43.72 20.18 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.627 2.218 . . . . 0.0 112.527 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.534 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 58.7 mtt180 -70.41 -15.48 62.84 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.833 0.853 . . . . 0.0 111.648 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.0 tp -53.63 -46.03 70.35 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.326 0.65 . . . . 0.0 110.213 168.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.82 -39.44 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 124.044 0.938 . . . . 0.0 111.317 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.534 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 20.2 mmt -71.68 -45.06 63.08 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.684 0.794 . . . . 0.0 111.874 -171.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.92 -26.91 65.33 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.506 0.722 . . . . 0.0 111.867 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -54.56 -44.2 72.7 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.123 0.569 . . . . 0.0 110.883 174.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -99.3 -13.66 19.56 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.841 0.456 . . . . 0.0 111.671 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 61.01 63.19 1.3 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.292 1.037 . . . . 0.0 111.868 -178.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.34 -2.47 12.63 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.22 0.608 . . . . 0.0 112.403 177.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -80.37 85.19 5.88 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 . . . . . 0 C--O 1.251 1.149 0 CA-C-N 114.885 -1.052 . . . . 0.0 108.545 -178.271 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -98.49 26.17 5.75 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.011 0.924 . . . . 0.0 110.026 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.1 p -62.4 93.57 0.05 Allowed 'General case' 0 C--N 1.356 0.888 0 C-N-CA 124.027 0.931 . . . . 0.0 110.277 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -139.6 77.02 1.59 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.805 -174.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.422 ' O ' HG22 ' A' ' 7' ' ' VAL . 19.4 mp0 -63.12 117.24 6.24 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 171.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 m -121.61 150.09 42.21 Favored 'General case' 0 C--O 1.249 1.051 0 C-N-CA 123.832 0.853 . . . . 0.0 109.425 -174.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.538 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -156.34 147.0 21.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.279 0.632 . . . . 0.0 111.136 -175.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.467 HH11 HG13 ' A' ' 4' ' ' VAL . 2.2 mpt_? -83.84 159.69 21.33 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.478 0.711 . . . . 0.0 110.127 174.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 121.008 0.432 . . . . 0.0 110.758 168.362 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 15.2 m -58.52 100.95 0.07 Allowed 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.799 173.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.1 m -62.73 95.02 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.006 0.523 . . . . 0.0 110.469 -177.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.64 -12.25 59.67 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 115.412 -0.813 . . . . 0.0 113.808 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 75.03 68.48 1.54 Allowed Glycine 0 C--N 1.349 1.29 0 N-CA-C 112.03 -0.428 . . . . 0.0 112.03 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -92.06 -30.37 16.06 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.629 0.772 . . . . 0.0 110.988 -177.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.188 0 C-N-CA 123.455 0.702 . . . . 0.0 109.421 178.229 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.908 0 CA-C-O 120.198 -0.223 . . . . 0.0 112.888 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -97.39 153.93 17.78 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.486 0.714 . . . . 0.0 111.277 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.511 ' HB2' ' HB2' ' B' ' 9' ' ' M3L . 45.4 mt-30 -108.88 94.0 4.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.113 0.965 . . . . 0.0 110.433 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.18 119.53 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -118.66 157.31 27.68 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.675 0.79 . . . . 0.0 109.625 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.51 123.86 21.99 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.054 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.484 HG21 HD12 ' A' ' 47' ' ' LEU . 12.4 m -97.1 153.28 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 123.696 0.798 . . . . 0.0 111.097 -173.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -81.95 -78.5 0.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 163.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.6 m -161.22 -173.75 4.0 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.997 1.319 . . . . 0.0 107.759 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.633 HD12 ' HB3' ' A' ' 22' ' ' TYR . 43.0 mm -81.09 115.72 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 169.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -57.68 6.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.123 0.969 . . . . 0.0 109.382 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -136.44 162.45 33.02 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.154 0.982 . . . . 0.0 110.008 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -146.58 141.09 26.6 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.706 0.803 . . . . 0.0 108.89 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -162.89 -176.57 4.99 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.687 1.195 . . . . 0.0 108.966 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.478 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 23.9 t -128.21 144.95 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -147.16 116.95 7.15 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt 65.73 28.74 10.95 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.563 1.145 . . . . 0.0 110.747 175.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.1 -12.97 58.76 Favored Glycine 0 C--N 1.352 1.455 0 CA-C-N 115.485 -0.779 . . . . 0.0 113.011 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -95.79 112.37 24.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.284 0.634 . . . . 0.0 109.639 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.478 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.0 t -70.41 119.95 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.451 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -94.0 142.35 27.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.514 0.725 . . . . 0.0 109.658 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.633 ' HB3' HD12 ' A' ' 10' ' ' ILE . 97.7 m-85 -130.4 108.08 9.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.284 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.1 tp -65.96 84.51 0.08 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.03 109.54 2.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -77.62 124.97 28.62 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 172.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m95 -97.84 136.53 38.03 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 28' ' ' GLY . 0.1 OUTLIER -65.25 -31.12 72.11 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -168.032 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.511 ' N ' ' HD3' ' A' ' 27' ' ' LYS . . . -97.78 2.56 60.33 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.946 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.405 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 60.4 m95 -124.58 133.36 24.69 Favored Pre-proline 0 N--CA 1.471 0.61 0 C-N-CA 123.576 0.75 . . . . 0.0 109.647 -172.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.12 165.18 12.94 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.028 2.485 . . . . 0.0 112.277 174.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -57.53 -23.36 56.01 Favored 'Trans proline' 0 C--N 1.39 2.745 0 C-N-CA 123.254 2.636 . . . . 0.0 114.154 -176.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.572 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -66.79 -13.33 61.35 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.13 0.572 . . . . 0.0 112.495 177.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.402 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 81.9 m-85 -113.86 1.39 14.76 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.585 0.754 . . . . 0.0 112.306 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.9 p -69.14 130.29 42.27 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 171.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.2 p -117.78 138.57 51.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.084 0.554 . . . . 0.0 111.404 -169.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -72.87 84.66 1.23 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.638 0.775 . . . . 0.0 109.087 176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -96.95 116.33 66.03 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.445 0.698 . . . . 0.0 109.131 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.72 176.2 4.55 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.464 2.109 . . . . 0.0 113.882 -175.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -50.41 -36.31 32.36 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.96 1.704 . . . . 0.0 113.212 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -60.84 -34.88 75.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.404 1.082 . . . . 0.0 112.382 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -83.37 -23.64 32.35 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.354 0.662 . . . . 0.0 112.258 -173.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.526 HG23 HG21 ' A' ' 48' ' ' VAL . 27.0 mm -71.93 108.45 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.563 HD13 ' HB ' ' B' ' 6' ' ' THR . 4.6 pp -99.46 -24.5 14.76 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 117.667 0.212 . . . . 0.0 111.505 -173.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -104.11 120.54 50.64 Favored Pre-proline 0 N--CA 1.475 0.801 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -64.83 -20.12 64.53 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.3 2.0 . . . . 0.0 111.583 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -61.19 -20.51 62.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.835 1.254 . . . . 0.0 112.222 177.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.496 ' HA ' HE21 ' B' ' 5' ' ' GLN . 16.7 tp -71.72 -47.49 53.54 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.056 0.542 . . . . 0.0 111.164 178.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.526 HG21 HG23 ' A' ' 42' ' ' ILE . 78.8 t -77.67 -37.72 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.346 0.658 . . . . 0.0 110.682 179.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.6 mmt -67.08 -41.06 87.01 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.14 -178.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.91 70.31 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.278 0.561 . . . . 0.0 111.493 178.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -71.8 -53.24 13.97 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.231 1.013 . . . . 0.0 110.937 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.11 -56.14 3.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.795 0.438 . . . . 0.0 111.236 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 64.85 16.58 10.56 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.608 1.163 . . . . 0.0 111.933 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.51 131.62 40.2 Favored 'General case' 0 C--N 1.353 0.718 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -95.66 15.79 19.03 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.228 1.011 . . . . 0.0 110.325 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 . . . . . 0 C--O 1.249 1.057 0 C-N-CA 124.41 1.084 . . . . 0.0 109.248 174.62 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 59.92 17.54 6.67 Favored 'General case' 0 N--CA 1.496 1.874 0 C-N-CA 125.223 1.409 . . . . 0.0 112.342 -173.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 39.8 p -99.46 131.16 45.65 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.35 1.06 . . . . 0.0 108.246 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.491 ' HZ3' ' HB2' ' B' ' 4' ' ' LYS . 0.1 OUTLIER -149.79 -176.17 5.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.87 0.468 . . . . 0.0 110.899 -171.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.496 HE21 ' HA ' ' A' ' 47' ' ' LEU . 49.0 tt0 -147.58 104.19 3.6 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -176.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.563 ' HB ' HD13 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -147.85 152.6 37.9 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.434 0.635 . . . . 0.0 111.692 -172.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.88 160.62 37.11 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.392 1.077 . . . . 0.0 109.494 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 -97.88 151.04 20.65 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.246 1.019 . . . . 0.0 109.198 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.511 ' HB2' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 121.249 0.547 . . . . 0.0 110.97 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 4.8 p -68.71 82.39 0.28 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.639 175.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.2 m -75.58 99.91 4.42 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.802 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 167.88 -142.64 7.63 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.849 -176.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -178.41 154.22 14.24 Favored Glycine 0 C--N 1.35 1.321 0 CA-C-N 117.341 0.571 . . . . 0.0 113.662 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -78.28 144.16 36.39 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 109.989 176.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.09 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 174.549 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.147 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.75 66.46 7.32 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.59 0.756 . . . . 0.0 111.12 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -92.58 107.64 19.37 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.827 175.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -96.79 140.88 16.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -130.26 142.03 50.58 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.264 0.626 . . . . 0.0 109.461 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 126.91 30.68 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.729 169.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.99 154.66 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.022 0.439 . . . . 0.0 111.565 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 42.9 tt0 -78.33 -63.57 1.37 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.946 172.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.6 m -165.56 173.39 10.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.681 1.192 . . . . 0.0 110.073 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.455 HD12 ' HB3' ' A' ' 22' ' ' TYR . 41.3 mm -85.11 126.59 40.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 162.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -52.79 6.26 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HA ' ' HH ' ' A' ' 51' ' ' TYR . 99.1 mttt -138.99 170.04 16.7 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.829 0.852 . . . . 0.0 110.17 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -156.61 145.63 20.29 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.131 0.573 . . . . 0.0 110.094 -173.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -159.93 169.88 22.55 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.896 0.878 . . . . 0.0 109.208 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.41 115.91 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 166.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -137.0 126.45 25.04 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -174.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 65.46 24.95 11.91 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.016 0.913 . . . . 0.0 110.374 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.89 -9.05 47.31 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.282 -0.872 . . . . 0.0 113.18 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -93.92 111.43 23.14 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 123.988 0.915 . . . . 0.0 108.918 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.405 ' HB ' ' HG3' ' A' ' 39' ' ' GLU . 23.6 t -77.17 106.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -98.4 138.6 35.4 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 123.96 0.904 . . . . 0.0 110.288 -173.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.455 ' HB3' HD12 ' A' ' 10' ' ' ILE . 59.0 m-85 -122.61 117.25 25.39 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 tp -71.07 81.77 0.69 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.592 HG23 ' HE2' ' A' ' 41' ' ' HIS . 85.6 t -75.88 110.35 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.009 -169.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -75.39 107.44 7.51 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.637 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 52.7 m95 -75.78 147.83 38.93 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.093 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.6 OUTLIER -64.46 -54.49 31.79 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.164 0.586 . . . . 0.0 112.146 -169.192 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.81 13.19 64.0 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 116.207 -0.451 . . . . 0.0 113.796 -175.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.637 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 70.5 m95 -117.78 141.43 29.08 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 123.526 0.73 . . . . 0.0 109.772 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.401 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 41.3 Cg_endo -64.59 160.83 38.06 Favored 'Trans proline' 0 CA--C 1.563 1.932 0 C-N-CA 122.904 2.403 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.16 -20.37 46.13 Favored 'Trans proline' 0 C--N 1.389 2.659 0 C-N-CA 123.604 2.869 . . . . 0.0 115.184 -177.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -74.22 -19.81 60.39 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.401 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 39.3 m-85 -96.22 5.72 50.4 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.793 0.837 . . . . 0.0 111.897 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.9 p -68.36 117.85 10.68 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.7 p -106.06 144.29 32.99 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.503 0.721 . . . . 0.0 110.797 -173.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.04 80.03 1.71 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.051 0.929 . . . . 0.0 109.889 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -83.82 120.79 75.59 Favored Pre-proline 0 C--O 1.242 0.682 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.953 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.35 155.63 69.04 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 121.933 1.755 . . . . 0.0 111.428 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.405 ' HG3' ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -49.89 -19.89 0.78 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.686 1.595 . . . . 0.0 114.849 -177.332 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -55.35 -32.72 62.78 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.461 1.104 . . . . 0.0 112.854 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.592 ' HE2' HG23 ' A' ' 24' ' ' VAL . 2.8 p-80 -82.07 -12.22 58.37 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.89 120.63 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.935 0.894 . . . . 0.0 110.335 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.461 HD11 HG21 ' B' ' 6' ' ' THR . 38.0 mt -110.02 2.23 19.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.756 0.423 . . . . 0.0 110.985 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -150.89 127.19 5.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.328 0.651 . . . . 0.0 110.622 -174.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.32 -37.33 40.74 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.943 2.428 . . . . 0.0 112.199 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -64.81 -18.49 65.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.452 0.701 . . . . 0.0 111.478 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.87 -52.59 48.98 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.224 0.61 . . . . 0.0 111.314 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.05 -37.64 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-O 121.567 0.699 . . . . 0.0 110.075 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.6 mmt -70.98 -29.24 65.15 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.847 -178.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -30.56 70.76 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.007 0.432 . . . . 0.0 110.692 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.409 ' HH ' ' HA ' ' A' ' 12' ' ' LYS . 68.1 t80 -76.07 -56.29 4.79 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.543 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.45 -54.47 5.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.079 0.551 . . . . 0.0 110.934 -171.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -88.96 58.16 4.45 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -81.87 124.42 29.69 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.948 -170.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -79.9 91.75 5.43 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.317 0.647 . . . . 0.0 109.711 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.798 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 51.6 22.54 1.61 Allowed 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 126.333 1.853 . . . . 0.0 113.596 177.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 37.1 p -75.56 76.03 2.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.713 0.805 . . . . 0.0 112.455 -169.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -86.85 -29.94 21.84 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.862 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.43 97.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.265 169.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.461 HG21 HD11 ' A' ' 43' ' ' LEU . 13.0 m -117.87 150.99 38.27 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.913 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -151.56 129.53 11.77 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.976 -175.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 -68.78 171.25 8.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.838 0.855 . . . . 0.0 110.792 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.689 0 CA-C-O 120.711 0.291 . . . . 0.0 111.394 167.073 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 43.4 m -60.76 89.95 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.058 0.943 . . . . 0.0 111.102 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 17.9 m -147.48 141.14 25.58 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 -2.55 57.37 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -171.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 85.63 -118.97 4.95 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 111.948 -0.461 . . . . 0.0 111.948 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm 61.21 16.74 7.51 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.947 1.299 . . . . 0.0 112.607 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 C-N-CA 124.267 1.027 . . . . 0.0 109.244 -176.648 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 65.94 98.92 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.01 1.324 . . . . 0.0 110.575 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.448 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 1.8 mp0 -105.41 105.66 15.8 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.736 0.815 . . . . 0.0 109.714 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -105.35 130.37 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.448 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 37.3 m-85 -130.18 164.05 25.32 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.545 0.738 . . . . 0.0 109.747 179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.35 115.05 5.87 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.517 HG21 HD11 ' A' ' 47' ' ' LEU . 14.2 m -79.94 156.06 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 123.085 0.554 . . . . 0.0 110.242 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 37.1 tt0 -85.75 -67.93 0.77 Allowed 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 161.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 m -164.99 -167.79 1.29 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.157 1.383 . . . . 0.0 108.142 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' HB3' ' A' ' 22' ' ' TYR . 46.4 mm -91.93 133.2 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 163.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -88.22 -54.8 4.03 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.406 ' HA ' ' HH ' ' A' ' 51' ' ' TYR . 97.7 mttt -136.83 176.87 8.32 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.718 0.807 . . . . 0.0 110.583 -178.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -153.62 144.7 22.88 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -160.18 -175.04 4.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.923 0.889 . . . . 0.0 109.272 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.9 p -142.81 132.5 22.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 173.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -134.27 105.4 6.61 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.134 0.974 . . . . 0.0 109.101 -172.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.6 39.52 29.79 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.79 1.236 . . . . 0.0 111.566 -178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.92 -18.27 56.26 Favored Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.811 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -87.13 110.57 20.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 117.077 0.438 . . . . 0.0 110.764 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -75.06 110.15 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.615 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 34.8 mt-10 -101.11 146.69 27.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.472 0.709 . . . . 0.0 110.538 -173.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.433 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.9 m-85 -127.16 119.25 26.02 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.3 tp -70.46 82.84 0.58 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.97 107.19 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -176.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -77.58 118.94 20.47 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.6 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 40.1 m95 -92.61 149.43 21.35 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.565 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 3.5 tppp? -61.13 -51.61 68.35 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.189 0.996 . . . . 0.0 112.991 -167.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.93 6.53 76.63 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.61 -0.328 . . . . 0.0 113.576 -177.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.6 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 36.1 m95 -121.46 132.52 24.2 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.806 0.843 . . . . 0.0 109.632 -169.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 47.3 Cg_endo -66.03 165.96 22.32 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.974 2.449 . . . . 0.0 112.78 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.0 0.44 2.57 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 123.46 2.773 . . . . 0.0 115.207 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -91.88 -31.61 15.62 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 118.233 0.469 . . . . 0.0 111.077 168.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.434 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 49.4 m-85 -86.08 -1.75 57.68 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.461 0.705 . . . . 0.0 111.343 175.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.1 p -70.9 141.09 51.18 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 168.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.68 141.54 51.58 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.818 0.447 . . . . 0.0 111.935 -170.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -76.35 85.29 3.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.202 1.001 . . . . 0.0 110.282 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -95.22 114.63 64.2 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.513 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.615 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 71.9 Cg_exo -53.63 172.35 0.25 Allowed 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 123.653 2.902 . . . . 0.0 114.845 176.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.26 66.29 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.857 -176.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -70.72 -29.27 65.5 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.897 0.479 . . . . 0.0 111.352 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -77.22 -33.03 56.25 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.231 0.612 . . . . 0.0 110.624 177.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.584 HG22 HD23 ' A' ' 47' ' ' LEU . 36.0 mm -71.79 116.9 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.1 15.39 23.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.565 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -134.37 127.97 19.07 Favored Pre-proline 0 N--CA 1.476 0.829 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.24 -56.53 1.54 Allowed 'Trans proline' 0 C--N 1.378 2.094 0 C-N-CA 122.594 2.196 . . . . 0.0 112.183 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.515 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 84.6 mtt85 -69.54 -15.27 63.2 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.75 0.82 . . . . 0.0 112.993 -170.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.584 HD23 HG22 ' A' ' 42' ' ' ILE . 23.8 tp -56.94 -44.36 82.45 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-O 121.121 0.486 . . . . 0.0 110.126 169.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.493 HG21 HG21 ' A' ' 42' ' ' ILE . 53.8 t -84.25 -48.85 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.469 1.107 . . . . 0.0 111.122 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.515 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.7 mmt -62.41 -37.97 87.86 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.214 -170.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.94 -45.43 85.81 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.818 0.447 . . . . 0.0 111.137 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.406 ' HH ' ' HA ' ' A' ' 12' ' ' LYS . 8.7 t80 -54.41 -50.73 66.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.088 0.955 . . . . 0.0 111.445 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -84.45 -6.14 59.35 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 63.23 27.45 15.55 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.141 0.976 . . . . 0.0 110.881 -173.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -78.93 84.62 4.95 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.171 0.988 . . . . 0.0 110.454 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -92.56 -17.06 24.92 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.76 0.824 . . . . 0.0 110.029 169.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 124.518 1.127 . . . . 0.0 110.834 175.9 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 37.98 39.34 0.24 Allowed 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 125.792 1.637 . . . . 0.0 113.273 -174.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.3 m -88.48 41.28 1.01 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.975 0.91 . . . . 0.0 110.029 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -73.94 -16.78 61.08 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.385 0.674 . . . . 0.0 109.383 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -57.98 104.5 0.2 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 165.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.9 p -141.85 159.61 41.87 Favored 'General case' 0 C--O 1.256 1.445 0 C-N-CA 123.902 0.881 . . . . 0.0 110.258 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.56 141.79 30.83 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.432 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -88.93 135.83 33.33 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.399 0.68 . . . . 0.0 109.406 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.79 0 O-C-N 123.085 0.241 . . . . 0.0 110.522 176.861 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 48.0 t -50.14 109.79 0.33 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.863 1.265 . . . . 0.0 111.508 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.2 p -75.3 -3.32 32.67 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.861 -176.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.94 103.74 0.9 Allowed Glycine 0 C--N 1.347 1.17 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 170.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.83 -48.0 51.67 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 -177.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.96 173.35 16.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.368 0.667 . . . . 0.0 110.621 176.307 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 124.858 1.263 . . . . 0.0 111.104 178.435 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -66.77 -38.15 86.02 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.525 0.73 . . . . 0.0 111.379 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -117.42 105.59 12.3 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.543 0.737 . . . . 0.0 110.176 -174.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.445 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.4 m -131.1 98.41 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.754 1.222 . . . . 0.0 109.426 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.16 156.29 22.54 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.133 0.573 . . . . 0.0 111.372 -172.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.25 139.67 38.89 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.018 169.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.1 m -120.23 157.11 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.68 0.792 . . . . 0.0 110.646 -171.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 5.9 tp10 -61.5 -65.21 0.73 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 164.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.01 -179.52 4.69 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.479 1.112 . . . . 0.0 109.412 -179.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.8 mm -75.19 106.33 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 161.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -63.07 -54.01 44.65 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.366 0.667 . . . . 0.0 110.191 -178.104 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -138.62 172.96 12.11 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.408 0.683 . . . . 0.0 110.389 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -153.39 127.17 8.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.852 0.861 . . . . 0.0 108.779 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.87 178.43 9.16 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.357 0.663 . . . . 0.0 110.373 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.62 116.05 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.759 0.824 . . . . 0.0 108.962 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -131.53 121.65 24.81 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.6 tptt 65.62 26.41 11.57 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.518 1.127 . . . . 0.0 110.672 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.66 -13.39 58.7 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.821 -176.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -86.95 110.55 20.1 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.261 0.625 . . . . 0.0 109.483 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.9 t -77.79 107.24 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -104.05 136.14 44.25 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.901 0.481 . . . . 0.0 110.275 -172.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -113.92 121.06 42.79 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.507 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.9 tp -71.36 113.93 8.91 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.403 HG21 ' CE1' ' A' ' 41' ' ' HIS . 13.1 t -100.5 108.14 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -170.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -77.3 110.39 11.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.238 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' SER . 38.8 m95 -87.18 133.31 33.66 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -80.34 -50.08 10.65 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.346 0.658 . . . . 0.0 111.543 -172.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.75 -4.19 87.84 Favored Glycine 0 CA--C 1.54 1.65 0 N-CA-C 114.03 0.372 . . . . 0.0 114.03 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.5 m95 -120.28 149.43 49.53 Favored Pre-proline 0 N--CA 1.48 1.036 0 C-N-CA 124.247 1.019 . . . . 0.0 109.956 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.06 150.97 87.25 Favored 'Trans proline' 0 C--N 1.382 2.298 0 C-N-CA 122.685 2.257 . . . . 0.0 112.601 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -54.75 -30.39 66.87 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 124.507 3.472 . . . . 0.0 116.013 -167.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -73.02 -17.02 61.48 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -78.97 -1.36 34.98 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.909 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.442 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 57.0 m -67.12 116.51 8.0 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 174.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 p -97.97 141.24 31.18 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.138 0.975 . . . . 0.0 111.139 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -78.96 105.6 10.4 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 167.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.418 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 13.1 mm-40 -121.34 126.99 26.33 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.236 1.014 . . . . 0.0 109.402 -173.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -57.26 142.43 94.71 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 123.565 2.843 . . . . 0.0 111.87 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -54.4 -24.36 19.45 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -164.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.88 -24.81 67.99 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 124.265 1.026 . . . . 0.0 112.003 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.418 ' CD2' ' HB3' ' A' ' 37' ' ' GLU . 2.7 p80 -70.43 -19.49 62.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.458 0.703 . . . . 0.0 112.457 -174.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.587 HG22 HD22 ' A' ' 47' ' ' LEU . 36.8 mm -71.44 134.08 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.334 0.654 . . . . 0.0 109.432 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.506 HD13 ' HB ' ' B' ' 6' ' ' THR . 31.7 mt -100.15 5.12 44.81 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.154 0.582 . . . . 0.0 111.534 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.477 ' H ' HG23 ' A' ' 42' ' ' ILE . 32.5 t70 -151.13 125.34 4.48 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 122.757 0.423 . . . . 0.0 111.379 -174.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -64.55 -37.05 39.77 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.526 2.151 . . . . 0.0 112.699 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.447 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 88.8 mtt-85 -68.27 -15.12 63.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.487 0.715 . . . . 0.0 111.989 -175.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.587 HD22 HG22 ' A' ' 42' ' ' ILE . 12.0 tp -69.06 -52.51 27.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.384 0.674 . . . . 0.0 110.598 173.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.18 -33.43 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 121.594 0.711 . . . . 0.0 109.609 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.447 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 97.7 mmm -73.74 -29.38 62.2 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.971 176.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 54' ' ' LYS . . . -67.3 -29.68 69.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.563 0.345 . . . . 0.0 110.347 174.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -71.7 -57.72 4.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.39 0.676 . . . . 0.0 110.709 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -79.23 -24.47 43.02 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.31 -168.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -107.1 16.34 24.25 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.248 0.619 . . . . 0.0 111.519 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 34.7 ttmt -73.12 168.49 18.98 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 66.08 18.73 11.07 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 124.464 1.106 . . . . 0.0 110.62 -173.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 C--O 1.246 0.893 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.324 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . 0.494 ' HB1' ' HB2' ' B' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.18 -51.4 58.16 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.919 0.888 . . . . 0.0 110.91 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 10.2 m -109.52 67.99 0.66 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.759 0.79 . . . . 0.0 109.092 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.494 ' HB2' ' HB1' ' B' ' 1' ' ' ALA . 20.8 tptm -94.29 69.68 3.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.461 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.7 mm100 -106.01 109.66 21.67 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.14 -175.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.506 ' HB ' HD13 ' A' ' 43' ' ' LEU . 19.4 p -74.66 128.74 36.29 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.475 0.71 . . . . 0.0 111.119 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.45 134.85 36.29 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.445 ' HG2' HG12 ' A' ' 4' ' ' VAL . 97.0 mtt180 -74.69 171.62 13.58 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.822 0.82 . . . . 0.0 112.503 -177.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.486 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.545 166.55 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 76.7 p -168.54 160.74 11.18 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.784 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 14.9 t -106.32 4.09 28.26 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.699 1.2 . . . . 0.0 109.987 167.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 174.95 168.26 35.34 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -133.23 21.2 4.13 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-N 118.29 1.045 . . . . 0.0 114.204 -174.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.478 ' HZ2' ' HB3' ' B' ' 14' ' ' LYS . 8.1 mtpm? -121.36 115.43 22.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.922 0.489 . . . . 0.0 110.676 -178.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.453 0.701 . . . . 0.0 110.171 178.35 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.878 0 N-CA-C 112.288 -0.325 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' B' ' 11' ' ' THR . 12.2 pt-20 -70.77 -179.61 2.27 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.547 0.739 . . . . 0.0 111.454 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -154.9 118.48 4.54 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.7 m -111.49 148.2 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.043 0.937 . . . . 0.0 110.58 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -146.78 164.07 33.97 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.816 0.847 . . . . 0.0 111.258 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.68 126.01 28.59 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.071 173.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.402 HG23 HD13 ' A' ' 47' ' ' LEU . 35.8 m -104.95 151.45 7.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 124.051 0.94 . . . . 0.0 111.025 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -86.17 -70.52 0.59 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 168.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.8 m -162.4 -177.63 5.78 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 125.176 1.39 . . . . 0.0 108.544 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.563 HD13 ' HB3' ' A' ' 22' ' ' TYR . 50.1 mm -76.5 119.84 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 168.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.11 -50.89 36.14 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -142.67 158.15 43.95 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.78 0.832 . . . . 0.0 110.565 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -142.76 125.46 15.93 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.303 0.641 . . . . 0.0 109.824 -169.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -154.52 175.22 13.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.568 0.747 . . . . 0.0 109.546 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.566 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 11.5 p -118.31 142.94 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 171.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -150.57 120.87 7.31 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.805 0.842 . . . . 0.0 108.983 -176.264 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 27.7 mtpp 60.98 29.45 19.02 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.396 1.078 . . . . 0.0 111.747 178.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.3 -13.44 65.12 Favored Glycine 0 C--N 1.353 1.51 0 CA-C-N 116.091 -0.504 . . . . 0.0 113.457 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -103.72 117.6 34.77 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.729 0.811 . . . . 0.0 110.092 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 53.0 t -69.33 110.14 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.621 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 69.5 mt-10 -98.7 144.51 27.89 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.203 1.001 . . . . 0.0 110.477 -176.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.563 ' HB3' HD13 ' A' ' 10' ' ' ILE . 74.5 m-85 -126.78 116.95 21.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.726 -1.124 . . . . 0.0 108.573 -174.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.58 102.2 0.88 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 166.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -87.65 117.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -81.65 113.38 19.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 172.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -84.26 125.28 32.09 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -61.19 -43.1 99.42 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.482 0.713 . . . . 0.0 112.048 -169.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.78 4.55 83.54 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-O 119.609 -0.551 . . . . 0.0 114.177 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.528 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 39.0 m95 -120.99 143.12 36.11 Favored Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 123.499 0.72 . . . . 0.0 110.177 -178.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.37 152.13 82.71 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.93 2.42 . . . . 0.0 111.914 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.75 -34.1 5.46 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 124.893 3.729 . . . . 0.0 117.108 -171.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -69.98 -17.37 63.29 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.812 0.733 . . . . 0.0 112.816 -173.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -88.54 4.97 44.89 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.854 0.462 . . . . 0.0 111.713 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -64.15 124.25 21.18 Favored 'General case' 0 C--N 1.351 0.655 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.0 p -112.13 127.3 55.89 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.291 0.636 . . . . 0.0 112.009 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -75.88 78.91 2.78 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.789 0.835 . . . . 0.0 109.919 175.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.448 ' HG3' ' HA ' ' B' ' 9' ' ' M3L . 13.8 mm-40 -104.47 143.69 27.2 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 92.4 Cg_endo -77.97 176.72 9.66 Favored 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 122.264 1.976 . . . . 0.0 113.474 -172.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -48.21 -22.45 0.66 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.887 1.675 . . . . 0.0 113.816 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -56.61 -31.01 63.88 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.69 1.596 . . . . 0.0 113.289 175.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.608 ' HD2' ' HB2' ' B' ' 7' ' ' ALA . 9.4 p-80 -87.13 -8.83 56.59 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.225 0.61 . . . . 0.0 112.359 -168.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 26.4 mm -80.18 122.69 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.124 0.569 . . . . 0.0 110.956 -171.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.571 HD13 ' HG3' ' B' ' 8' ' ' ARG . 6.8 mp -96.29 -15.97 21.63 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 177.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -150.94 130.46 6.6 Favored Pre-proline 0 N--CA 1.473 0.677 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -176.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.63 -25.35 54.56 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 123.162 2.575 . . . . 0.0 113.692 -173.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.12 -19.53 61.61 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.004 0.522 . . . . 0.0 111.546 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.402 HD13 HG23 ' A' ' 7' ' ' VAL . 10.7 tp -60.29 -47.21 87.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.881 0.472 . . . . 0.0 110.994 176.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.37 -46.65 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.512 0.725 . . . . 0.0 110.448 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -62.46 -54.26 42.71 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.762 -175.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.23 70.04 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.13 0.423 . . . . 0.0 111.692 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.17 -56.92 15.59 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.898 0.479 . . . . 0.0 109.955 172.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -72.85 -18.89 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.178 0.591 . . . . 0.0 111.044 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 63.49 24.57 14.13 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.327 1.451 . . . . 0.0 109.527 -165.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -70.26 108.26 4.1 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 125.682 1.593 . . . . 0.0 109.771 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -136.87 76.44 1.59 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 C--O 1.249 1.048 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 175.969 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -129.49 148.33 51.38 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.393 1.077 . . . . 0.0 109.542 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 37.8 m -103.71 115.83 31.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.682 0.793 . . . . 0.0 109.298 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -66.9 135.88 54.52 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 174.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 -65.2 -40.48 94.25 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.005 0.522 . . . . 0.0 110.632 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 10.9 m 70.05 138.59 0.04 OUTLIER 'General case' 0 C--O 1.253 1.287 0 C-N-CA 124.604 1.162 . . . . 0.0 112.231 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.608 ' HB2' ' HD2' ' A' ' 41' ' ' HIS . . . -146.37 135.39 22.57 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.334 -175.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.571 ' HG3' HD13 ' A' ' 43' ' ' LEU . 44.7 mtp180 -74.41 163.51 27.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 166.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.448 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 168.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 76.3 p -158.88 159.77 35.39 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.19 178.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.434 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 55.2 m -78.73 100.6 7.15 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.64 93.62 0.18 Allowed Glycine 0 C--N 1.343 0.941 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.675 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -155.63 -70.18 0.01 OUTLIER Glycine 0 C--N 1.339 0.746 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -111.05 139.07 46.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.928 0.891 . . . . 0.0 109.458 176.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.829 0 C-N-CA 123.822 0.849 . . . . 0.0 109.917 -178.519 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.6 m -124.77 142.51 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.651 0.78 . . . . 0.0 110.614 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -135.41 163.21 30.55 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.285 1.034 . . . . 0.0 109.173 176.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.03 105.72 3.43 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.4 0.68 . . . . 0.0 109.376 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.498 HG12 ' CZ3' ' A' ' 26' ' ' TRP . 1.6 m -87.56 154.13 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.906 -176.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -82.08 -79.99 0.17 Allowed 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.0 m -160.21 -174.04 4.33 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.517 1.127 . . . . 0.0 108.804 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.558 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.4 mm -80.88 134.72 26.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 172.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.73 4.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.902 0.881 . . . . 0.0 109.571 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -133.43 153.72 51.37 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.979 0.911 . . . . 0.0 109.306 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -135.73 135.32 39.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.7 ptm85 -162.47 173.36 14.15 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.606 0.762 . . . . 0.0 110.106 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 20' ' ' VAL . 14.4 t -119.34 119.9 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 175.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -118.93 110.75 17.52 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.985 0.914 . . . . 0.0 110.059 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp 60.55 31.5 20.26 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 124.287 1.035 . . . . 0.0 111.832 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.48 10.04 62.42 Favored Glycine 0 C--N 1.352 1.467 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.377 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -124.64 111.82 16.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.956 0.903 . . . . 0.0 109.98 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 15' ' ' VAL . 38.4 t -70.62 108.15 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.666 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 18.9 pt-20 -107.57 151.26 25.85 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.796 0.808 . . . . 0.0 110.696 -176.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.558 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -130.71 125.88 35.06 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.33 -173.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.8 tp -73.89 83.2 1.69 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.1 t -68.59 111.08 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -76.74 117.56 18.48 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.498 ' CZ3' HG12 ' A' ' 7' ' ' VAL . 26.6 m95 -90.46 121.1 32.12 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 176.019 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -70.43 -37.75 74.45 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -161.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.04 -10.99 84.21 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 116.523 -0.308 . . . . 0.0 113.268 177.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.409 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.8 m95 -108.43 148.99 38.75 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.618 1.167 . . . . 0.0 109.165 -177.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 56.9 Cg_endo -66.9 159.65 50.68 Favored 'Trans proline' 0 CA--C 1.559 1.742 0 C-N-CA 122.092 1.861 . . . . 0.0 111.141 177.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.93 -16.22 48.15 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.966 2.444 . . . . 0.0 113.449 -176.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -31.22 65.61 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.169 0.588 . . . . 0.0 111.694 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.41 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 29.2 m-85 -88.65 9.74 23.12 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.526 0.73 . . . . 0.0 111.802 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.7 m -75.33 132.39 40.94 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.7 p -121.4 168.25 11.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.621 0.768 . . . . 0.0 111.059 -172.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -97.39 95.18 7.5 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.253 0.621 . . . . 0.0 110.997 -175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -96.96 122.88 55.31 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 123.645 0.778 . . . . 0.0 109.327 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 59.4 Cg_endo -69.03 171.24 14.0 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.085 1.857 . . . . 0.0 112.291 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -27.17 44.66 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.143 0.977 . . . . 0.0 111.774 174.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.87 -34.9 70.25 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.47 1.508 . . . . 0.0 111.293 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -98.64 -19.76 17.36 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.187 0.995 . . . . 0.0 111.511 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.672 HG23 HD23 ' A' ' 47' ' ' LEU . 51.2 mm -71.35 114.42 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 123.024 0.53 . . . . 0.0 109.974 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.424 HD21 ' HD3' ' B' ' 8' ' ' ARG . 31.1 mt -83.65 -50.49 8.14 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.552 0.691 . . . . 0.0 110.14 -177.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -93.39 133.14 28.83 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.525 -166.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.26 -38.62 8.63 Favored 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.625 2.217 . . . . 0.0 112.201 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.503 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 47.6 mtm180 -69.82 -17.18 63.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.316 1.046 . . . . 0.0 111.119 -176.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.672 HD23 HG23 ' A' ' 42' ' ' ILE . 19.6 tp -59.21 -48.73 80.53 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 123.901 0.88 . . . . 0.0 111.142 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 80.7 t -84.46 -38.73 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.509 0.724 . . . . 0.0 110.675 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.503 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 57.7 mtt -64.94 -32.12 73.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.348 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.94 82.31 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.88 0.472 . . . . 0.0 109.862 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -58.84 -38.19 78.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.495 1.118 . . . . 0.0 111.718 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -176.194 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.475 ' O ' HG22 ' A' ' 7' ' ' VAL . 4.8 pm0 . . . . . 0 CA--C 1.549 0.933 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 23.8 m -146.99 153.25 39.84 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.105 0.478 . . . . 0.0 111.903 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.07 148.6 42.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.863 1.265 . . . . 0.0 108.858 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.424 ' HD3' HD21 ' A' ' 43' ' ' LEU . 2.8 mpt_? . . . . . 0 N--CA 1.484 1.27 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 170.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.6 mp0 . . . . . 0 CA--C 1.543 0.689 0 CA-C-O 120.763 0.316 . . . . 0.0 111.544 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.15 126.84 52.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 123.775 0.83 . . . . 0.0 109.362 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 38.7 m-85 -131.0 152.74 49.99 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.297 0.639 . . . . 0.0 110.583 -177.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.15 107.72 1.65 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.311 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 HD13 ' A' ' 47' ' ' LEU . 20.3 m -90.85 155.88 3.05 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.314 1.046 . . . . 0.0 110.742 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -83.22 -74.01 0.38 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 161.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.6 m -161.4 -177.57 6.07 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.325 1.05 . . . . 0.0 109.628 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.6 mm -76.33 114.49 16.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 172.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.0 -51.48 38.85 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 123.343 0.657 . . . . 0.0 109.369 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -139.28 155.82 47.48 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.792 0.837 . . . . 0.0 110.355 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -146.12 134.33 21.69 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.093 0.957 . . . . 0.0 109.071 -175.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.439 HH21 ' HB2' ' A' ' 16' ' ' ARG . 7.2 ptm180 -163.21 -174.55 3.87 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.708 1.203 . . . . 0.0 109.465 -173.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -136.66 139.73 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.541 0.736 . . . . 0.0 109.18 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' HH21 ' A' ' 14' ' ' ARG . 22.3 tpt180 -141.72 132.24 25.34 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt 59.49 26.12 15.02 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.599 1.16 . . . . 0.0 112.102 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.05 23.71 73.71 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.414 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -125.68 120.87 31.87 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.641 0.776 . . . . 0.0 109.288 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 28.1 t -73.88 112.96 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.293 0.637 . . . . 0.0 110.348 -174.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -96.86 147.87 23.51 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.493 0.717 . . . . 0.0 110.604 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HB2' ' HE1' ' A' ' 41' ' ' HIS . 90.9 m-85 -132.4 112.35 12.09 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.989 0.916 . . . . 0.0 109.735 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.98 101.0 3.1 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 164.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 88.3 t -93.36 123.61 45.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-O 121.054 0.454 . . . . 0.0 110.321 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -83.98 107.76 16.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.821 172.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 9.1 m95 -83.19 119.05 24.06 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 174.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -69.17 -28.33 66.32 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.269 0.486 . . . . 0.0 111.816 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.39 -23.18 77.66 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.595 -0.275 . . . . 0.0 113.283 175.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 15.0 m95 -107.97 139.37 20.6 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.211 1.004 . . . . 0.0 109.54 -174.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -62.31 156.36 51.57 Favored 'Trans proline' 0 CA--C 1.563 1.964 0 C-N-CA 122.469 2.113 . . . . 0.0 111.86 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.79 -26.48 17.83 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.92 3.08 . . . . 0.0 115.427 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -67.44 -14.29 62.8 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -111.27 18.55 19.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.984 0.914 . . . . 0.0 111.692 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 p -68.69 123.18 20.2 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.0 p -121.28 167.15 13.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.272 0.629 . . . . 0.0 111.588 -172.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -111.16 121.73 46.06 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.204 1.002 . . . . 0.0 109.394 -173.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -129.54 146.44 61.08 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -75.76 174.79 12.22 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.127 1.885 . . . . 0.0 112.701 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 10.8 pt-20 -49.58 -28.28 5.49 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 126.308 1.843 . . . . 0.0 114.613 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.76 -33.7 61.59 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.881 1.272 . . . . 0.0 112.44 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 3.4 p-80 -81.67 -18.83 43.17 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -168.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.7 mm -72.87 113.57 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.95 0.5 . . . . 0.0 109.681 -176.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -88.38 -33.56 17.88 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.98 0.419 . . . . 0.0 110.634 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.455 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 13.6 t70 -119.69 130.64 24.74 Favored Pre-proline 0 N--CA 1.48 1.043 0 C-N-CA 123.822 0.849 . . . . 0.0 110.709 -174.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.95 -36.08 40.48 Favored 'Trans proline' 0 C--N 1.381 2.271 0 C-N-CA 123.066 2.511 . . . . 0.0 113.008 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -65.37 -23.55 67.01 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.06 0.544 . . . . 0.0 111.05 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.402 HD13 HG21 ' A' ' 7' ' ' VAL . 34.6 tp -56.7 -52.37 65.21 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.652 0.781 . . . . 0.0 111.202 173.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.7 t -71.83 -51.86 29.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.846 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 23.1 mmt -62.09 -28.46 69.63 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.409 -1.269 . . . . 0.0 112.667 -172.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.87 -44.79 92.01 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 121.289 0.566 . . . . 0.0 111.002 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -72.11 -36.85 69.55 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.324 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 . . . . . 0 N--CA 1.475 0.801 0 C-N-CA 122.441 0.296 . . . . 0.0 111.185 -177.985 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 3.0 mp0 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -65.47 145.04 56.62 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 123.695 0.798 . . . . 0.0 111.59 -172.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -137.72 116.69 12.43 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.143 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 41.6 mtm180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.493 175.272 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 CA--C 1.55 0.961 0 CA-C-O 120.437 0.16 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' B' ' 8' ' ' ARG . 33.4 m -132.07 142.42 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 123.683 0.793 . . . . 0.0 109.821 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -135.53 160.29 38.93 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.044 0.938 . . . . 0.0 110.218 -177.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.73 114.81 4.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.528 0.731 . . . . 0.0 109.927 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.6 m -80.02 153.0 4.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.187 0.518 . . . . 0.0 110.698 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 37.3 tt0 -94.19 -62.33 1.36 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.58 -172.79 2.0 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.528 1.531 . . . . 0.0 108.559 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 mm -91.92 139.45 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 164.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -50.28 4.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.457 0.703 . . . . 0.0 109.916 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -137.55 171.26 14.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.385 0.674 . . . . 0.0 110.603 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.72 134.2 15.39 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -173.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -155.67 -178.0 6.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.987 0.915 . . . . 0.0 110.047 -174.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.97 139.57 33.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 108.805 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -149.83 108.97 3.92 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.134 0.973 . . . . 0.0 108.844 -170.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm 59.99 32.36 21.07 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.243 1.017 . . . . 0.0 111.242 -177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.66 -17.83 56.77 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 115.27 -0.877 . . . . 0.0 113.55 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.88 111.95 21.98 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.043 0.537 . . . . 0.0 110.481 -177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.09 110.48 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 177.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -103.61 148.47 25.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.456 1.102 . . . . 0.0 109.833 -172.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -128.77 123.75 33.73 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -71.7 83.12 0.87 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -65.74 105.93 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.6 112.78 14.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 37.0 m95 -83.89 147.48 27.49 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 177.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 87.9 tttt -62.77 -53.86 47.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.714 0.806 . . . . 0.0 112.33 -166.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.57 1.12 83.67 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 54.5 m95 -116.86 134.99 22.9 Favored Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 123.218 0.607 . . . . 0.0 110.812 -171.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.99 167.68 25.35 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 123.276 2.651 . . . . 0.0 112.712 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -51.45 -28.63 28.49 Favored 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 123.855 3.037 . . . . 0.0 115.34 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -72.73 -28.4 62.63 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.494 0.318 . . . . 0.0 111.318 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -102.86 11.27 37.71 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.49 0.716 . . . . 0.0 111.069 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.443 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.7 m -86.97 137.34 32.44 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 167.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.3 p -110.94 139.22 46.47 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.366 0.666 . . . . 0.0 110.918 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.81 76.32 5.3 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.726 0.811 . . . . 0.0 110.031 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -91.48 122.37 66.02 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 123.55 0.74 . . . . 0.0 109.218 -178.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 19.1 Cg_exo -68.76 174.98 7.82 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.732 2.288 . . . . 0.0 112.95 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.69 -15.58 30.43 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.77 1.228 . . . . 0.0 112.268 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' A' ' 38' ' ' PRO . 40.6 mm-40 -55.35 -42.97 74.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.734 1.214 . . . . 0.0 110.922 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -105.13 -9.56 17.7 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.765 -171.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.584 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -71.92 112.24 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.596 HD12 ' HB ' ' B' ' 6' ' ' THR . 35.6 mt -71.07 -21.73 62.2 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -172.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -143.55 128.09 9.53 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 122.825 0.45 . . . . 0.0 110.198 -169.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.48 -35.11 98.89 Favored 'Trans proline' 0 C--N 1.38 2.19 0 C-N-CA 122.79 2.327 . . . . 0.0 112.91 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -67.57 -20.29 65.37 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.693 0.397 . . . . 0.0 111.839 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.584 HD23 HG23 ' A' ' 42' ' ' ILE . 24.0 tp -57.39 -42.78 82.89 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.054 0.388 . . . . 0.0 110.423 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 48.8 t -87.81 -46.74 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.663 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtt -63.7 -46.93 83.24 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.764 0.825 . . . . 0.0 112.53 -172.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.58 -33.44 75.61 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 123.642 0.589 . . . . 0.0 110.683 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.36 -48.47 81.62 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.507 0.504 . . . . 0.0 110.445 169.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' VAL . 46.2 mt-10 . . . . . 0 N--CA 1.485 1.292 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -173.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.522 ' HG3' ' HB2' ' A' ' 47' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 121.467 0.651 . . . . 0.0 111.401 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.596 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.0 m -148.86 162.08 40.56 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.899 1.28 . . . . 0.0 108.629 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.74 150.52 47.65 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.559 ' HA ' HG12 ' A' ' 4' ' ' VAL . 12.0 mmm-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 121.07 0.462 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.1 m -99.82 152.3 4.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.386 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -131.19 143.94 50.97 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.859 0.463 . . . . 0.0 110.172 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.19 110.21 4.46 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.175 175.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 18.5 m -97.13 154.56 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.768 0.427 . . . . 0.0 111.295 -172.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 36.1 tt0 -81.08 -69.83 0.58 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 170.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.9 m -166.21 -177.6 4.2 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.836 1.254 . . . . 0.0 109.487 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.9 mm -76.61 142.46 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 167.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.2 -46.69 4.36 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -143.04 165.07 28.38 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.489 1.116 . . . . 0.0 109.928 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -153.69 128.67 9.58 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.783 0.833 . . . . 0.0 108.775 -169.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.409 HH12 ' HD3' ' A' ' 16' ' ' ARG . 3.8 ptm180 -155.85 -174.3 4.9 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.218 1.007 . . . . 0.0 109.467 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -135.59 129.81 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HD3' HH12 ' A' ' 14' ' ' ARG . 54.2 ttp85 -133.74 119.39 19.23 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.151 0.98 . . . . 0.0 109.157 -178.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.86 27.76 16.13 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.403 1.081 . . . . 0.0 111.52 177.023 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.16 10.87 79.65 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.442 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 111.99 23.23 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 70.6 t -70.93 109.88 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -96.62 145.17 25.98 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.432 0.634 . . . . 0.0 110.095 -171.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.442 ' HB3' HD12 ' A' ' 10' ' ' ILE . 96.5 m-85 -127.21 111.49 14.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.589 -1.187 . . . . 0.0 107.869 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 tp -66.61 81.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 167.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.411 HG21 ' NE2' ' A' ' 41' ' ' HIS . 95.6 t -77.37 116.15 20.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -78.05 111.2 13.71 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 170.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 5.6 m95 -85.3 140.53 30.75 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 4.3 tppp? -58.0 -57.36 13.14 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -168.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.44 1.39 88.87 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.924 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 61.8 m95 -115.15 128.2 26.15 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.421 0.689 . . . . 0.0 109.918 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.72 175.67 6.92 Favored 'Trans proline' 0 CA--C 1.572 2.416 0 C-N-CA 123.32 2.68 . . . . 0.0 112.905 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -65.11 -13.36 39.37 Favored 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.607 2.204 . . . . 0.0 114.614 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -79.99 -8.72 59.5 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 122.187 -0.321 . . . . 0.0 111.423 173.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -114.9 -8.74 12.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.982 0.913 . . . . 0.0 111.778 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.6 p -64.25 117.02 6.59 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 169.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.5 p -122.87 148.2 45.7 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.958 0.409 . . . . 0.0 111.745 -169.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.74 87.46 4.64 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.646 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -102.51 133.74 20.34 Favored Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.25 166.57 26.5 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.236 2.624 . . . . 0.0 114.135 -171.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 12.4 pt-20 -49.58 -29.82 7.65 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.469 1.907 . . . . 0.0 114.785 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.24 -45.49 91.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.723 0.809 . . . . 0.0 111.55 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.53 ' HB2' ' HB2' ' B' ' 8' ' ' ARG . 2.1 p-80 -62.74 -17.22 60.51 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -172.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.69 111.69 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.315 0.646 . . . . 0.0 109.825 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.589 HD21 ' HG2' ' B' ' 8' ' ' ARG . 53.8 mt -81.8 -15.25 54.81 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 120.908 0.385 . . . . 0.0 111.453 -176.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -144.87 119.7 5.8 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 123.431 0.692 . . . . 0.0 109.662 -164.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.22 -34.19 79.19 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 122.584 2.189 . . . . 0.0 112.269 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.5 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.9 mtt85 -65.77 -20.11 66.14 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.174 0.99 . . . . 0.0 110.774 -173.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.1 tp -59.47 -52.03 67.34 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.444 1.098 . . . . 0.0 111.272 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 39.4 t -78.85 -35.0 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.299 0.639 . . . . 0.0 109.915 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.5 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.6 mmt -68.5 -28.83 67.36 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.526 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.9 -30.56 56.23 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 122.882 0.473 . . . . 0.0 111.328 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -61.03 -50.53 72.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.138 0.575 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 . . . . . 0 N--CA 1.476 0.84 0 C-N-CA 123.809 0.844 . . . . 0.0 111.53 -179.156 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.401 ' O ' HG22 ' A' ' 7' ' ' VAL . 2.1 mp0 . . . . . 0 C--O 1.239 0.512 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -139.93 162.31 35.48 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 124.338 1.055 . . . . 0.0 109.813 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.519 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.78 141.66 24.71 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.831 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.589 ' HG2' HD21 ' A' ' 43' ' ' LEU . 19.5 mmt85 . . . . . 0 N--CA 1.485 1.3 0 C-N-CA 123.906 0.883 . . . . 0.0 111.849 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.444 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 85.5 mt-30 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.5 m -112.0 123.85 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.771 0.828 . . . . 0.0 109.152 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 21.8 m-85 -124.79 162.78 23.54 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.641 0.776 . . . . 0.0 109.588 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.87 112.78 4.47 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.334 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.54 HG21 HD13 ' A' ' 47' ' ' LEU . 32.7 m -74.55 154.34 6.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.283 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.7 tp10 -89.24 -64.96 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 166.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.2 m -165.01 175.2 9.68 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.827 1.251 . . . . 0.0 108.685 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.52 HD11 ' HG ' ' A' ' 47' ' ' LEU . 41.3 mm -78.95 117.71 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 162.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.525 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -72.46 -56.49 5.33 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.525 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.1 mttm -132.76 161.74 33.29 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.411 0.684 . . . . 0.0 110.956 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -146.54 136.55 23.46 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.414 1.085 . . . . 0.0 108.4 -176.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -159.79 177.55 10.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.045 0.538 . . . . 0.0 110.303 -173.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 20' ' ' VAL . 22.2 t -130.15 118.27 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 169.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.495 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 13.8 tpt85 -146.12 137.9 24.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.354 1.062 . . . . 0.0 108.895 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mtmt 64.99 25.05 12.68 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.278 1.031 . . . . 0.0 111.095 -178.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.05 4.83 84.14 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.876 -0.602 . . . . 0.0 113.411 -175.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -116.49 130.82 56.96 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.963 0.905 . . . . 0.0 110.312 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 15' ' ' VAL . 46.3 t -79.23 108.29 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 39.0 mt-10 -101.16 147.26 26.45 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.151 0.581 . . . . 0.0 110.356 -171.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -129.04 123.13 31.53 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.058 0.943 . . . . 0.0 108.902 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.6 tp -76.12 88.07 3.02 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 167.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.5 HG21 ' NE2' ' A' ' 41' ' ' HIS . 91.9 t -78.13 111.3 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.082 0.553 . . . . 0.0 110.116 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 4.9 tmtm? -83.18 132.4 35.07 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -106.36 135.2 48.26 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 19.9 ttmm -56.27 -59.97 4.18 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -165.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.27 17.98 25.69 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.437 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -122.92 134.7 25.2 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.211 1.004 . . . . 0.0 109.542 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -56.27 155.85 23.24 Favored 'Trans proline' 0 CA--C 1.567 2.125 0 C-N-CA 123.464 2.776 . . . . 0.0 113.378 -177.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -47.34 -38.27 26.25 Favored 'Trans proline' 0 C--N 1.383 2.376 0 C-N-CA 124.357 3.371 . . . . 0.0 116.029 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -81.8 -9.05 59.73 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -91.95 10.25 29.67 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.71 0.804 . . . . 0.0 111.53 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.8 m -71.2 137.9 49.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 169.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 p -119.78 147.52 44.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.863 0.465 . . . . 0.0 111.43 -171.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -94.43 119.59 33.38 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.962 0.905 . . . . 0.0 110.213 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -138.73 147.53 54.87 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 123.204 0.602 . . . . 0.0 109.631 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 16.0 Cg_exo -65.31 177.73 2.44 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 123.251 2.634 . . . . 0.0 113.12 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.54 -15.88 59.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.794 0.838 . . . . 0.0 112.587 -178.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.82 -23.76 66.75 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.847 1.259 . . . . 0.0 112.766 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.585 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 1.6 p-80 -89.37 -7.26 55.61 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.1 mm -71.08 112.93 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.559 0.744 . . . . 0.0 110.423 -175.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.6 mt -90.28 -10.82 42.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.013 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -150.69 131.01 6.97 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.637 -174.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -61.17 -33.0 91.47 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.174 2.583 . . . . 0.0 113.049 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 39.0 mmt180 -65.32 -15.73 62.84 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.381 0.672 . . . . 0.0 112.092 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.567 ' HB2' ' HB3' ' B' ' 5' ' ' GLN . 14.1 tp -64.57 -48.25 75.69 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.043 0.537 . . . . 0.0 110.737 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.32 -32.71 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.301 0.64 . . . . 0.0 110.251 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.595 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 52.7 mtt -61.57 -48.96 78.58 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.189 0.995 . . . . 0.0 111.396 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.74 -28.46 69.9 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.392 0.677 . . . . 0.0 111.475 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.87 -55.62 16.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.701 0.401 . . . . 0.0 110.984 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 . . . . . 0 N--CA 1.479 0.988 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.714 -170.798 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.567 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.8 mp0 . . . . . 0 CA--C 1.541 0.626 0 CA-C-O 121.545 0.688 . . . . 0.0 110.408 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 p -82.42 172.37 13.13 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 -170.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -162.8 133.6 4.79 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.859 -169.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? . . . . . 0 N--CA 1.494 1.764 0 C-N-CA 122.834 0.454 . . . . 0.0 110.075 175.96 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.565 0.221 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -97.92 153.38 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.987 0.915 . . . . 0.0 111.351 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.524 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 54.6 m-85 -137.46 156.77 47.78 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.568 1.147 . . . . 0.0 108.152 171.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 27' ' ' LYS . . . -68.81 125.67 27.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.35 0.66 . . . . 0.0 110.522 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.14 154.06 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.377 0.671 . . . . 0.0 110.25 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 12.7 tp10 -83.82 -69.52 0.63 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.4 m -158.86 -161.14 0.93 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.977 1.311 . . . . 0.0 108.16 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.449 HG23 ' HB3' ' A' ' 22' ' ' TYR . 48.1 mm -90.71 121.7 41.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.025 0.53 . . . . 0.0 109.98 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -77.41 -55.03 5.73 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.097 0.959 . . . . 0.0 109.836 -179.572 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -135.51 171.64 14.15 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.214 0.606 . . . . 0.0 110.552 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -155.81 143.31 19.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.023 0.529 . . . . 0.0 110.587 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -165.56 163.1 19.41 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.373 1.069 . . . . 0.0 108.556 175.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 14.0 p -101.31 137.82 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 168.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -153.39 127.99 9.37 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.292 0.637 . . . . 0.0 109.552 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.7 tptt 65.52 26.26 11.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.748 1.219 . . . . 0.0 111.077 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.82 3.71 90.44 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.524 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -119.27 119.16 33.24 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.759 0.824 . . . . 0.0 109.598 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 34.6 t -71.01 107.49 2.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 176.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 9.1 pt-20 -100.16 137.92 37.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.993 0.917 . . . . 0.0 109.72 -177.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.449 ' HB3' HG23 ' A' ' 10' ' ' ILE . 42.4 m-85 -116.75 123.19 46.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.115 -1.402 . . . . 0.0 107.838 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 tp -67.25 88.18 0.18 Allowed 'General case' 0 C--N 1.347 0.475 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 165.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.86 126.37 31.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 28.1 tptp -77.49 99.86 5.83 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.524 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 62.0 m95 -75.08 105.02 5.89 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 173.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HE2' ' HB1' ' A' ' 6' ' ' ALA . 65.5 pttt -70.31 -20.01 63.04 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -162.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.25 -13.06 79.85 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 123.002 0.189 . . . . 0.0 112.653 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -125.17 152.65 71.13 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 109.735 -170.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.03 165.1 33.49 Favored 'Trans proline' 0 CA--C 1.567 2.127 0 C-N-CA 122.455 2.103 . . . . 0.0 111.603 172.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.79 -20.64 69.92 Favored 'Trans proline' 0 C--N 1.391 2.804 0 C-N-CA 123.214 2.609 . . . . 0.0 113.793 -174.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -80.2 -29.16 38.57 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.391 0.277 . . . . 0.0 111.6 176.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -87.69 -6.49 58.2 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.044 0.538 . . . . 0.0 110.745 173.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' HD1' ' A' ' 26' ' ' TRP . 49.1 m -78.55 157.91 28.67 Favored 'General case' 0 C--N 1.353 0.754 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -139.37 155.18 47.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 120.612 0.244 . . . . 0.0 111.601 -164.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -87.27 92.25 9.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.2 1.0 . . . . 0.0 111.129 -175.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 8' ' ' ARG . 5.3 mp0 -104.78 121.49 46.66 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 124.243 1.017 . . . . 0.0 109.976 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 35.5 Cg_exo -61.44 174.42 2.1 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.933 2.422 . . . . 0.0 114.121 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.33 -13.81 61.11 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.546 -175.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -25.58 53.15 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.233 0.213 . . . . 0.0 111.377 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -80.04 -25.07 40.3 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.533 0.733 . . . . 0.0 111.4 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.643 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -68.37 127.82 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.045 0.938 . . . . 0.0 110.46 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.624 HD12 ' HB ' ' B' ' 6' ' ' THR . 56.9 mt -77.15 -64.09 1.22 Allowed 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.106 0.479 . . . . 0.0 110.956 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -100.65 133.5 21.18 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.498 -172.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -59.56 -30.82 93.33 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 123.219 2.613 . . . . 0.0 113.343 -175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.458 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 67.7 mtp180 -69.48 -16.04 63.38 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.58 0.752 . . . . 0.0 112.045 -176.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.643 HD23 HG23 ' A' ' 42' ' ' ILE . 20.2 tp -59.93 -43.57 94.87 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 120.968 0.413 . . . . 0.0 110.642 172.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 77.3 t -82.74 -48.89 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.417 175.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.458 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -65.66 -31.69 72.84 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.645 1.178 . . . . 0.0 113.303 -169.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.25 -37.46 69.12 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.829 0.347 . . . . 0.0 110.884 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -66.13 -39.16 89.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.507 0.723 . . . . 0.0 110.344 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 . . . . . 0 N--CA 1.474 0.743 0 C-N-CA 123.683 0.793 . . . . 0.0 111.836 178.285 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.518 ' HB3' HD13 ' A' ' 47' ' ' LEU . 84.6 mm-40 . . . . . 0 C--O 1.242 0.66 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.624 ' HB ' HD12 ' A' ' 43' ' ' LEU . 30.9 m -150.75 157.72 43.29 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 124.003 0.921 . . . . 0.0 109.03 -173.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.81 161.95 36.74 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.953 0.901 . . . . 0.0 109.702 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 37' ' ' GLU . 5.2 mpt_? . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 . . . . . 0 CA--C 1.542 0.669 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.578 HG12 ' HG2' ' B' ' 8' ' ' ARG . 31.1 m -101.89 137.76 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.583 0.753 . . . . 0.0 109.788 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -134.21 159.94 39.39 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 124.062 0.945 . . . . 0.0 109.29 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.59 144.3 32.49 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.951 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.456 HG21 HD13 ' A' ' 47' ' ' LEU . 22.7 m -91.09 154.81 3.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.099 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.5 tt0 -82.88 -57.89 3.11 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 160.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -163.52 177.65 8.65 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.917 1.287 . . . . 0.0 109.351 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.1 mm -81.2 114.94 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 162.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -54.84 18.3 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.75 0.82 . . . . 0.0 109.453 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -143.59 169.82 17.0 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.8 0.84 . . . . 0.0 111.092 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -149.23 135.41 19.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.53 1.132 . . . . 0.0 108.888 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -160.74 175.51 12.53 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.556 0.743 . . . . 0.0 109.16 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -117.94 114.84 46.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 CA-C-O 121.511 0.672 . . . . 0.0 109.573 170.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -105.9 97.67 7.46 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 124.878 1.271 . . . . 0.0 109.678 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 62.16 41.88 10.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 172.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.13 -15.11 63.67 Favored Glycine 0 N--CA 1.472 1.097 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.301 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm -88.4 109.93 20.41 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.435 0.694 . . . . 0.0 109.2 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.29 106.14 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 77.5 mt-10 -114.09 150.19 34.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.718 -168.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -122.6 116.7 24.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.438 -1.71 . . . . 0.0 108.2 -176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.0 tp -69.22 104.27 2.16 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.431 HG21 ' NE2' ' A' ' 41' ' ' HIS . 14.8 t -94.08 108.68 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -170.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -76.89 120.73 22.43 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.1 m95 -93.24 153.26 18.7 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.12 0.568 . . . . 0.0 110.433 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -70.98 -9.27 57.69 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -163.611 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -149.47 24.17 1.21 Allowed Glycine 0 N--CA 1.474 1.221 0 CA-C-N 117.937 0.335 . . . . 0.0 112.342 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 51.0 m95 -123.4 136.9 27.65 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 124.131 0.972 . . . . 0.0 108.484 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -59.13 159.76 21.12 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 122.941 2.427 . . . . 0.0 112.959 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -53.39 -30.2 51.78 Favored 'Trans proline' 0 C--N 1.382 2.297 0 C-N-CA 123.393 2.729 . . . . 0.0 114.278 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.1 -15.02 58.76 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -99.85 17.24 21.3 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.598 0.759 . . . . 0.0 111.698 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -81.1 141.19 34.54 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.2 p -110.19 130.13 55.6 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -169.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.58 96.46 1.97 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.838 0.455 . . . . 0.0 109.986 170.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -123.47 131.58 24.29 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.155 0.982 . . . . 0.0 109.92 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.594 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 84.4 Cg_endo -70.59 170.63 17.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.131 2.554 . . . . 0.0 113.672 -175.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -53.39 -17.11 1.67 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.847 1.259 . . . . 0.0 114.316 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.29 -39.24 89.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.933 0.893 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.47 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 9.3 p-80 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.806 0.442 . . . . 0.0 111.996 -177.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.8 mm -67.85 116.01 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 124.324 1.049 . . . . 0.0 110.515 -175.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.2 mt -99.22 8.55 44.7 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.954 0.502 . . . . 0.0 111.348 -176.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -150.08 118.98 3.7 Favored Pre-proline 0 N--CA 1.483 1.199 0 C-N-CA 123.581 0.753 . . . . 0.0 109.714 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.47 -36.8 52.55 Favored 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 122.954 2.436 . . . . 0.0 112.576 -177.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -65.12 -22.33 66.92 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 125.221 1.408 . . . . 0.0 111.469 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.456 HD13 HG21 ' A' ' 7' ' ' VAL . 16.9 tp -59.56 -52.17 66.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.816 0.846 . . . . 0.0 111.375 174.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.88 -42.23 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.569 0.699 . . . . 0.0 111.02 178.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -74.46 -26.81 60.27 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.649 -171.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.93 -29.05 55.47 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.126 0.571 . . . . 0.0 111.11 175.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -59.44 -45.75 90.7 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.529 0.731 . . . . 0.0 109.953 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 . . . . . 0 N--CA 1.475 0.818 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.581 178.025 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 . . . . . 0 C--O 1.237 0.417 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.4 p -76.06 148.39 38.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.268 -176.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.47 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.94 132.3 16.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.824 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG2' HG12 ' A' ' 4' ' ' VAL . 23.4 mtm180 . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.207 0.603 . . . . 0.0 111.074 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.276 0.084 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.4 HG12 ' HG2' ' B' ' 8' ' ' ARG . 35.5 m -85.5 138.62 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.688 0.795 . . . . 0.0 110.756 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -131.12 157.61 42.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.764 0.826 . . . . 0.0 109.771 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.17 107.22 10.6 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 123.578 0.751 . . . . 0.0 109.333 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.91 154.2 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.832 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.1 tt0 -93.44 -52.94 4.27 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.409 0.683 . . . . 0.0 109.668 177.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -161.93 168.21 23.3 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.67 1.188 . . . . 0.0 109.839 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.459 HD13 HG22 ' A' ' 24' ' ' VAL . 32.4 mm -77.28 115.07 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 162.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.437 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -69.86 -58.61 3.67 Favored 'General case' 0 CA--C 1.556 1.177 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.082 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.437 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.0 mtpp -139.08 171.48 14.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.978 0.911 . . . . 0.0 110.994 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -154.32 133.05 12.2 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.651 1.18 . . . . 0.0 108.569 -171.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -160.23 179.57 8.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.981 0.913 . . . . 0.0 110.074 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 8.9 p -129.81 138.04 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.461 0.704 . . . . 0.0 109.966 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -138.74 100.68 4.13 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.503 1.121 . . . . 0.0 108.904 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 60.59 36.86 19.71 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.127 0.971 . . . . 0.0 111.43 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.58 -10.77 73.52 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.2 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -99.8 108.84 21.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.218 0.607 . . . . 0.0 110.18 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 59.9 t -76.95 112.31 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.608 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -96.27 139.3 32.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.669 0.788 . . . . 0.0 109.835 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -118.72 110.18 16.96 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.7 tp -69.84 105.37 2.76 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 167.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.584 HG21 ' HE1' ' A' ' 41' ' ' HIS . 76.2 t -101.05 118.88 48.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -77.39 115.66 17.34 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 171.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 11.1 m95 -90.38 144.44 25.81 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 30.5 ttmt -64.23 -53.85 42.75 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -166.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.83 1.46 86.28 Favored Glycine 0 CA--C 1.533 1.172 0 N-CA-C 113.798 0.279 . . . . 0.0 113.798 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.6 m95 -114.81 135.8 22.44 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.741 0.816 . . . . 0.0 109.322 -177.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -64.51 160.7 38.41 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 C-N-CA 122.467 2.111 . . . . 0.0 112.038 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.52 -22.25 21.22 Favored 'Trans proline' 0 C--N 1.384 2.416 0 C-N-CA 123.531 2.821 . . . . 0.0 114.48 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -77.39 -35.78 54.03 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.507 0.323 . . . . 0.0 111.489 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -82.9 0.38 44.58 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.071 0.549 . . . . 0.0 111.242 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.1 m -70.67 140.83 51.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.43 0.692 . . . . 0.0 109.669 171.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -132.06 156.49 46.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.267 0.627 . . . . 0.0 111.811 -167.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -95.41 112.28 24.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.528 1.131 . . . . 0.0 109.351 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.3 mp0 -116.95 144.39 33.41 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.612 0.765 . . . . 0.0 109.435 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.82 160.5 49.42 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 123.081 2.521 . . . . 0.0 112.171 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -50.33 -28.59 8.17 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 125.921 1.688 . . . . 0.0 114.629 -167.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.748 ' HG2' HH22 ' B' ' 8' ' ' ARG . 39.4 tt0 -64.1 -30.11 71.2 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.587 0.755 . . . . 0.0 112.224 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.584 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.1 p80 -64.1 -22.52 66.97 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.48 114.24 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.18 0.592 . . . . 0.0 109.53 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.3 mt -85.04 -63.88 1.25 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -77.75 118.37 71.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.003 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.79 -25.61 39.38 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.501 2.134 . . . . 0.0 111.961 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -70.98 -16.69 62.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.667 0.787 . . . . 0.0 111.03 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' B' ' 5' ' ' GLN . 14.5 tp -60.48 -52.92 63.16 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.964 . . . . 0.0 111.255 172.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.2 t -76.35 -38.65 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.274 0.63 . . . . 0.0 109.764 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtm -67.95 -27.99 67.08 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.229 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.24 -43.85 49.3 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.976 0.353 . . . . 0.0 110.051 175.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -56.19 -54.81 40.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.056 0.542 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.479 0.989 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.971 179.9 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.486 ' HB2' HD13 ' A' ' 47' ' ' LEU . 21.7 pt20 . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 11.2 m -127.11 141.65 51.71 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.279 0.632 . . . . 0.0 110.37 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.84 148.76 31.23 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.136 0.974 . . . . 0.0 109.819 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.748 HH22 ' HG2' ' A' ' 40' ' ' GLU . 70.3 mtm-85 . . . . . 0 N--CA 1.478 0.959 0 C-N-CA 123.218 0.607 . . . . 0.0 110.783 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.494 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.3 mp0 . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 120.282 0.087 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 m -115.72 125.61 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.948 0.899 . . . . 0.0 110.439 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.494 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 83.4 m-85 -122.36 155.89 35.08 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.011 0.524 . . . . 0.0 110.499 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.45 110.32 3.08 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.072 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.624 HG21 HD13 ' A' ' 47' ' ' LEU . 16.4 m -84.16 154.66 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.54 0.736 . . . . 0.0 110.391 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.2 tt0 -91.23 -65.64 1.0 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 171.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.3 m -163.44 175.51 10.7 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.329 1.452 . . . . 0.0 108.251 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.509 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.7 mm -74.78 119.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 165.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -74.19 -45.04 50.93 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -156.38 159.69 38.98 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.237 0.615 . . . . 0.0 109.928 -175.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -149.91 147.55 28.05 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.328 0.651 . . . . 0.0 109.905 -172.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -168.2 -173.99 2.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.22 1.008 . . . . 0.0 109.323 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -126.56 123.13 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.737 0.815 . . . . 0.0 108.893 173.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -150.07 150.35 31.6 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.93 24.85 13.78 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.625 1.17 . . . . 0.0 111.128 -173.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.71 16.05 67.38 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-N 116.102 -0.499 . . . . 0.0 113.235 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -126.7 145.85 50.43 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.466 1.106 . . . . 0.0 109.219 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.18 112.5 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -96.08 140.67 30.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.406 0.683 . . . . 0.0 109.977 -175.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HB3' HD12 ' A' ' 10' ' ' ILE . 93.3 m-85 -125.97 109.8 12.87 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.993 0.917 . . . . 0.0 109.077 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.7 tp -68.87 89.44 0.4 Allowed 'General case' 0 C--N 1.344 0.355 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.546 HG21 ' NE2' ' A' ' 41' ' ' HIS . 89.9 t -85.93 115.98 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 122.85 0.46 . . . . 0.0 109.886 -174.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -79.23 111.38 15.41 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.3 m95 -83.41 130.01 35.02 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.9 ttpt -62.09 -51.23 68.77 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.08 8.78 59.5 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 123.204 0.315 . . . . 0.0 113.658 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 65.8 m95 -123.42 137.96 29.33 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.084 0.954 . . . . 0.0 109.338 -174.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.506 ' HG2' ' CD1' ' A' ' 33' ' ' TYR . 29.7 Cg_endo -63.87 153.7 74.13 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 122.946 2.431 . . . . 0.0 113.212 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -38.53 -47.95 2.55 Favored 'Trans proline' 0 C--N 1.389 2.707 1 C-N-CA 125.888 4.392 . . . . 0.0 117.293 -171.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -72.36 -17.58 61.82 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -171.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.506 ' CD1' ' HG2' ' A' ' 30' ' ' PRO . 76.8 m-85 -84.6 7.54 19.82 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.246 0.618 . . . . 0.0 111.961 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.6 p -68.49 124.24 23.03 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 167.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 p -112.33 142.15 45.19 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.158 0.583 . . . . 0.0 111.086 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -77.14 81.71 3.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.784 0.834 . . . . 0.0 109.17 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -94.08 127.51 44.69 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.174 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.43 175.84 9.52 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.425 2.083 . . . . 0.0 113.263 -173.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.07 -34.2 9.27 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.794 1.637 . . . . 0.0 113.797 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -58.58 -30.02 66.86 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.737 1.215 . . . . 0.0 112.934 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.568 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.0 p-80 -84.48 -16.76 41.34 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -170.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.4 mm -67.31 123.37 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.065 0.546 . . . . 0.0 109.882 -176.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.554 HD21 ' HG2' ' B' ' 8' ' ' ARG . 30.0 mt -99.22 -44.82 6.11 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.822 0.344 . . . . 0.0 110.469 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 26.3 t70 -110.74 129.27 24.14 Favored Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.67 -176.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.26 -27.03 41.38 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 123.107 2.538 . . . . 0.0 113.571 -175.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.598 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 41.4 mmt180 -70.13 -15.68 63.0 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.947 0.499 . . . . 0.0 111.507 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.624 HD13 HG21 ' A' ' 7' ' ' VAL . 18.9 tp -58.91 -44.43 91.25 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.549 0.74 . . . . 0.0 110.368 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -89.13 -35.9 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.316 0.646 . . . . 0.0 110.664 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.598 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 75.8 mmm -68.76 -33.94 74.74 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.028 0.931 . . . . 0.0 112.243 -175.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.07 -28.42 63.32 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.582 0.353 . . . . 0.0 110.497 175.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -75.24 -45.42 40.26 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.242 1.017 . . . . 0.0 111.65 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 . . . . . 0 N--CA 1.475 0.823 0 C-N-CA 122.855 0.462 . . . . 0.0 111.059 -175.202 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.415 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 3.3 mp0 . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 5.1 p -122.98 162.91 21.41 Favored 'General case' 0 C--O 1.248 1.021 0 C-N-CA 124.079 0.952 . . . . 0.0 110.22 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.568 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -157.19 126.69 6.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.408 -172.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.554 ' HG2' HD21 ' A' ' 43' ' ' LEU . 14.8 mmt85 . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 172.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.701 0.286 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.78 140.1 18.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.126 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -134.29 141.7 47.04 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 171.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.13 113.19 4.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.294 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.45 HG22 ' O ' ' B' ' 5' ' ' GLN . 15.9 m -90.07 154.55 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.019 0.527 . . . . 0.0 111.132 -173.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -84.18 -68.98 0.67 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 168.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -159.4 -179.6 8.09 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mm -83.0 121.36 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -60.21 2.35 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.252 1.021 . . . . 0.0 108.54 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -137.67 169.82 17.13 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.956 0.902 . . . . 0.0 110.523 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -153.65 128.17 9.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.814 0.846 . . . . 0.0 109.083 -170.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -162.61 -173.74 3.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.222 1.009 . . . . 0.0 110.104 -176.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.38 143.89 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.148 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 4.1 ttm180 -147.98 115.07 6.16 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.108 0.963 . . . . 0.0 108.614 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 55.5 mtpt 63.84 32.43 13.39 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.159 0.984 . . . . 0.0 111.851 172.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.47 -15.15 63.01 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.261 -0.881 . . . . 0.0 113.021 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -96.58 110.68 23.04 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.689 0.796 . . . . 0.0 109.588 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.98 109.49 8.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -97.62 137.97 35.73 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 122.747 0.419 . . . . 0.0 110.32 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -115.51 110.22 18.95 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 167.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.1 tp -67.13 101.79 0.94 Allowed 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.476 HG21 ' HE1' ' A' ' 41' ' ' HIS . 71.9 t -97.42 122.62 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 122.221 0.209 . . . . 0.0 111.092 -172.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -78.57 119.46 21.87 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -89.0 140.55 29.32 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.97 0.908 . . . . 0.0 109.429 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -62.0 -51.46 67.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.063 0.545 . . . . 0.0 112.399 -168.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.43 9.14 78.12 Favored Glycine 0 C--N 1.346 1.084 0 N-CA-C 114.071 0.388 . . . . 0.0 114.071 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.9 m95 -127.84 137.62 31.15 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -175.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -64.2 159.01 45.27 Favored 'Trans proline' 0 C--N 1.377 2.044 0 C-N-CA 122.608 2.205 . . . . 0.0 111.812 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -60.09 -11.73 16.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.61 2.873 . . . . 0.0 115.708 -171.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -80.32 -18.32 49.51 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 118.851 0.75 . . . . 0.0 111.323 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -88.91 2.22 54.13 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.739 0.815 . . . . 0.0 111.407 172.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 t -64.13 123.53 19.3 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.2 p -119.1 156.82 29.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.689 0.796 . . . . 0.0 110.912 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -95.17 116.21 28.43 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.785 0.834 . . . . 0.0 108.833 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -119.5 149.76 48.49 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 123.497 0.719 . . . . 0.0 109.381 171.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.16 149.56 81.89 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 121.943 1.762 . . . . 0.0 110.409 168.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -56.6 -16.38 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.522 1.129 . . . . 0.0 113.991 -168.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.63 -28.44 65.66 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.757 1.223 . . . . 0.0 112.477 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.476 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.2 p80 -72.9 -15.6 61.58 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.504 HG21 HG23 ' A' ' 48' ' ' VAL . 37.4 mm -69.89 120.37 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 123.599 0.759 . . . . 0.0 109.666 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.509 HD21 ' HG3' ' B' ' 8' ' ' ARG . 26.0 mt -86.58 -15.41 39.94 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.616 0.366 . . . . 0.0 111.344 -177.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -147.9 125.86 5.91 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.201 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -55.61 -31.74 80.45 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.785 2.99 . . . . 0.0 113.86 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.452 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.3 mmt180 -65.22 -16.8 63.93 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.413 HD13 HG21 ' A' ' 7' ' ' VAL . 13.3 tp -69.61 -48.42 60.15 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.182 0.593 . . . . 0.0 110.595 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.504 HG23 HG21 ' A' ' 42' ' ' ILE . 26.1 t -69.01 -39.47 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 CA-C-O 121.439 0.638 . . . . 0.0 109.903 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 93.5 mtp -69.81 -32.57 71.09 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 114.328 -1.305 . . . . 0.0 111.236 -176.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -28.62 69.84 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.357 0.663 . . . . 0.0 111.639 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -64.48 -55.31 21.55 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.486 0.714 . . . . 0.0 110.85 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 N--CA 1.484 1.266 0 C-N-CA 123.357 0.663 . . . . 0.0 110.462 -173.841 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.45 ' O ' HG22 ' A' ' 7' ' ' VAL . 5.2 pm0 . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -136.43 165.74 25.11 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 123.881 0.872 . . . . 0.0 110.796 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.439 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -153.44 140.08 18.89 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.671 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.509 ' HG3' HD21 ' A' ' 43' ' ' LEU . 70.0 mtm180 . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 123.02 0.528 . . . . 0.0 109.673 174.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.5 m -82.73 138.07 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 122.989 0.516 . . . . 0.0 110.58 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -135.06 146.1 48.61 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 123.832 0.853 . . . . 0.0 108.947 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.65 120.61 13.76 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.742 0.817 . . . . 0.0 109.55 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 9.5 m -95.78 153.48 3.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 C-N-CA 123.03 0.532 . . . . 0.0 110.183 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 36.0 tt0 -86.57 -65.59 1.0 Allowed 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 170.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -158.79 -179.27 7.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.373 1.069 . . . . 0.0 109.168 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -88.93 121.88 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 163.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -62.4 1.65 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -125.15 171.58 10.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.434 0.694 . . . . 0.0 111.476 -176.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -155.27 144.44 20.94 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 109.68 -173.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -168.56 -175.98 2.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.259 1.024 . . . . 0.0 109.41 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.14 127.9 20.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 52.2 ttt-85 -140.69 125.81 18.49 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HG2' ' HG2' ' A' ' 16' ' ' ARG . 72.7 mmtt 64.44 25.16 13.3 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.48 1.112 . . . . 0.0 111.507 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.65 74.53 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.156 -0.474 . . . . 0.0 113.204 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -89.89 110.6 21.54 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.021 0.928 . . . . 0.0 108.905 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 t -77.88 105.47 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.71 137.3 36.82 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.264 0.626 . . . . 0.0 110.019 -169.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -126.51 112.57 15.72 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.9 tp -69.2 86.91 0.4 Allowed 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.34 112.6 6.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 C-N-CA 123.199 0.6 . . . . 0.0 109.656 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -77.55 110.53 12.43 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 171.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.3 m95 -82.71 153.71 25.19 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 39.6 ttmt -70.8 -60.84 2.02 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.138 0.575 . . . . 0.0 112.33 -167.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.07 6.83 77.84 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 116.252 -0.431 . . . . 0.0 113.13 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.9 m95 -118.06 134.64 23.31 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.223 1.009 . . . . 0.0 109.072 -177.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.83 171.4 12.29 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.795 2.33 . . . . 0.0 111.858 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.5 -14.53 44.89 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 122.78 2.32 . . . . 0.0 113.664 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -83.28 -6.72 59.57 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.303 0.641 . . . . 0.0 112.227 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -114.94 13.22 17.0 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.031 0.932 . . . . 0.0 110.613 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.2 m -82.37 133.42 35.22 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 27.3 p -116.16 143.39 45.56 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.912 0.885 . . . . 0.0 110.494 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -71.09 82.12 0.69 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 170.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -101.33 109.48 58.92 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.551 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.45 162.95 31.59 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.537 2.158 . . . . 0.0 113.336 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -54.05 -26.55 27.2 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.178 1.391 . . . . 0.0 112.165 174.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -56.27 -31.88 64.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.275 1.43 . . . . 0.0 111.628 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -113.36 -10.93 13.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.887 0.875 . . . . 0.0 112.097 -174.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 44.3 mm -65.61 141.63 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 170.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.9 pp -113.38 -12.25 13.03 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.812 1.187 . . . . 0.0 112.214 178.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -101.26 117.02 63.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 173.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.12 -38.0 93.31 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.438 2.092 . . . . 0.0 110.323 166.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 21.2 mmm180 -62.3 -23.25 66.63 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.194 0.998 . . . . 0.0 113.292 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 19.5 tp -66.52 -52.52 44.93 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 118.26 0.482 . . . . 0.0 110.674 178.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 90.7 t -72.94 -37.61 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.034 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.408 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 61.4 mtt -60.5 -38.83 85.59 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.705 0.802 . . . . 0.0 111.268 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.06 -33.96 76.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.577 0.751 . . . . 0.0 110.581 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -69.06 -41.27 77.82 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.344 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.0 mm-40 . . . . . 0 N--CA 1.486 1.334 0 C-N-CA 122.74 0.416 . . . . 0.0 110.845 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 . . . . . 0 CA--C 1.551 1.018 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.589 ' HB ' HD11 ' A' ' 43' ' ' LEU . 27.2 m -150.72 145.15 25.61 Favored 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 123.99 0.916 . . . . 0.0 111.278 -169.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -131.36 149.66 52.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.082 0.953 . . . . 0.0 109.615 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.46 ' HG3' HD23 ' A' ' 43' ' ' LEU . 78.9 mtm180 . . . . . 0 N--CA 1.474 0.727 0 C-N-CA 124.075 0.95 . . . . 0.0 108.921 175.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 121.121 0.486 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.53 143.25 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.842 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -139.93 150.59 44.73 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.063 0.945 . . . . 0.0 109.702 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.91 131.12 45.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.925 176.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.5 m -116.46 154.27 18.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.129 0.571 . . . . 0.0 111.383 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 26.3 tt0 -85.14 -58.79 2.54 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.441 1.096 . . . . 0.0 108.503 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.8 m -174.95 -178.65 1.27 Allowed 'General case' 0 C--O 1.243 0.751 0 C-N-CA 126.525 1.93 . . . . 0.0 108.025 178.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.517 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 45.0 mm -78.18 124.5 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -61.14 1.9 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.64 0.776 . . . . 0.0 109.123 176.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.429 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 67.4 mttm -133.99 156.64 47.82 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.856 0.863 . . . . 0.0 110.148 178.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -145.68 141.72 28.35 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.425 0.69 . . . . 0.0 109.466 -176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -165.21 -173.17 2.77 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.398 1.079 . . . . 0.0 109.357 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -135.39 119.33 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.408 0.623 . . . . 0.0 110.359 175.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -102.21 97.62 7.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.187 0.995 . . . . 0.0 108.731 173.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp 56.58 52.75 9.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.357 1.063 . . . . 0.0 113.096 168.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 -3.19 85.85 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.731 -0.668 . . . . 0.0 113.561 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -111.89 111.76 22.94 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 36.9 t -77.77 112.94 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -96.8 138.06 34.93 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.13 0.972 . . . . 0.0 109.876 -171.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.5 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.0 m-85 -127.74 110.14 12.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.162 0.985 . . . . 0.0 109.246 -178.169 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.429 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.5 tp -69.68 101.69 1.72 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.935 -1.505 . . . . 0.0 106.935 165.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 41' ' ' HIS . 25.6 t -93.21 117.72 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 122.495 0.318 . . . . 0.0 110.383 -171.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -80.13 110.9 15.97 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 56.9 m95 -85.55 77.67 9.82 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.131 0.491 . . . . 0.0 109.895 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 85.2 tttt 52.56 -91.15 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.907 1.683 . . . . 0.0 113.022 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -121.61 14.17 9.27 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 122.877 0.275 . . . . 0.0 113.037 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 25.4 m95 -70.84 129.17 90.01 Favored Pre-proline 0 N--CA 1.473 0.698 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 171.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.42 146.4 62.76 Favored 'Trans proline' 0 C--N 1.379 2.15 0 C-N-CA 122.866 2.377 . . . . 0.0 112.068 -175.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -44.74 -29.08 3.25 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 124.623 3.549 . . . . 0.0 116.865 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -74.37 -7.46 52.95 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -104.98 0.98 28.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.998 0.919 . . . . 0.0 111.745 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.6 p -71.94 123.29 22.4 Favored 'General case' 0 C--N 1.351 0.666 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 171.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.0 p -114.42 139.3 49.61 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 0.0 111.934 -169.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -77.49 86.3 3.85 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.328 1.051 . . . . 0.0 110.06 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -101.52 137.78 19.7 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.012 0.925 . . . . 0.0 109.916 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.11 161.41 26.4 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 122.208 1.938 . . . . 0.0 112.634 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -38.37 -33.08 0.09 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 127.291 2.236 . . . . 0.0 116.196 -171.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.78 -30.03 70.14 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.05 0.94 . . . . 0.0 112.635 -172.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 24' ' ' VAL . 6.5 p-80 -71.77 -12.54 61.35 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.8 mm -71.54 128.95 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.086 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.577 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.6 pp -108.52 -4.49 17.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 119.818 1.19 . . . . 0.0 112.853 176.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.9 p-10 -139.58 153.99 70.92 Favored Pre-proline 0 N--CA 1.481 1.081 0 C-N-CA 122.482 0.313 . . . . 0.0 111.484 -171.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -67.66 -40.15 10.58 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.226 1.951 . . . . 0.0 112.793 176.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -61.25 -28.22 69.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.853 0.861 . . . . 0.0 113.116 -165.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.43 -52.46 32.47 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.451 0.7 . . . . 0.0 112.496 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.11 -36.15 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-O 121.43 0.633 . . . . 0.0 110.391 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mtp -74.53 -28.34 60.92 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.319 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.48 -37.81 88.84 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.378 0.671 . . . . 0.0 110.995 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.9 t80 -54.52 -51.79 64.04 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.348 1.059 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 . . . . . 0 N--CA 1.473 0.707 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.929 -174.301 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.247 0.968 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 43' ' ' LEU . 28.4 m -149.33 153.2 37.1 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.288 1.042 . . . . 0.0 110.805 -167.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -142.96 150.05 39.18 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.554 -178.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.409 ' CZ ' ' HB3' ' A' ' 43' ' ' LEU . 2.2 mpt_? . . . . . 0 N--CA 1.478 0.974 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.407 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.7 m -90.59 143.57 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.64 0.776 . . . . 0.0 110.503 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -139.61 138.18 35.96 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.643 0.777 . . . . 0.0 110.589 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.87 115.21 20.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 164.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.0 m -105.59 158.04 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.334 0.654 . . . . 0.0 111.576 -165.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.88 -56.14 8.86 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.773 0.67 . . . . 0.0 111.21 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -162.02 177.5 9.7 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.942 0.897 . . . . 0.0 110.225 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -83.83 119.61 33.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 157.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.497 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.7 tmt_? -71.42 -62.94 1.23 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.497 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.4 mttt -128.09 160.16 32.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.68 0.792 . . . . 0.0 110.61 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -146.34 140.23 26.25 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.815 1.246 . . . . 0.0 107.788 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -163.89 -175.57 4.14 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.127 0.571 . . . . 0.0 110.03 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.7 p -139.26 124.02 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.434 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 79.0 ttt180 -123.14 106.04 10.43 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.215 1.406 . . . . 0.0 108.569 -173.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 16' ' ' ARG . 37.3 mtmt 65.95 25.49 11.07 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.758 1.223 . . . . 0.0 111.702 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.43 -13.94 66.43 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.603 -0.271 . . . . 0.0 113.0 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -84.76 110.96 19.18 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.242 0.617 . . . . 0.0 110.275 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.525 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 41.1 t -73.2 111.57 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -107.58 144.43 34.62 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.435 0.694 . . . . 0.0 110.864 -171.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -130.2 113.92 15.05 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.042 0.937 . . . . 0.0 110.255 -175.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.2 tp -74.56 93.83 2.56 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 166.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 59.6 t -87.36 116.12 29.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 C-N-CA 122.69 0.396 . . . . 0.0 110.406 -173.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -74.92 113.68 12.5 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.156 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.9 m95 -84.54 132.97 34.46 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.011 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -81.97 110.62 17.39 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 123.475 0.485 . . . . 0.0 109.886 -172.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 113.16 -16.96 22.29 Favored Glycine 0 N--CA 1.473 1.108 0 O-C-N 123.724 0.64 . . . . 0.0 111.681 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 20.6 m95 -107.83 130.54 22.67 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 123.963 0.905 . . . . 0.0 108.901 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 23.8 Cg_endo -59.96 154.61 49.43 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.444 2.096 . . . . 0.0 112.599 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -51.22 -17.8 4.31 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 124.605 3.536 . . . . 0.0 116.166 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -79.96 -35.43 37.65 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.678 0.391 . . . . 0.0 111.138 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.446 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 41.9 m-85 -77.88 -11.36 59.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.468 0.707 . . . . 0.0 111.064 173.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.2 t -61.55 132.29 52.88 Favored 'General case' 0 C--N 1.358 0.972 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.1 p -127.72 164.14 22.78 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.075 0.55 . . . . 0.0 111.572 -170.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -100.16 116.59 32.54 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.39 1.076 . . . . 0.0 109.826 -172.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.41 153.37 72.29 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 168.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.59 -177.51 3.41 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.355 2.037 . . . . 0.0 114.214 -174.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.525 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 9.8 pt-20 -52.02 -31.43 29.78 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.267 1.827 . . . . 0.0 112.687 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.65 -45.99 92.02 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.721 1.208 . . . . 0.0 112.214 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 1.1 p-80 -75.52 -13.7 60.37 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -170.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.8 mm -66.87 104.84 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 175.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.569 HD12 ' HB ' ' B' ' 6' ' ' THR . 20.3 mt -90.39 -51.9 5.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.98 125.46 83.82 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.034 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.44 -37.52 13.14 Favored 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 122.901 2.401 . . . . 0.0 112.313 177.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -63.03 -21.76 66.38 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.764 0.826 . . . . 0.0 111.727 -177.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.1 -50.89 71.89 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.97 0.908 . . . . 0.0 111.618 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 46.8 t -80.24 -43.4 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.967 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.7 mtt -59.68 -45.38 92.26 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.301 1.04 . . . . 0.0 112.412 -175.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -27.27 63.33 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.218 0.607 . . . . 0.0 111.143 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.21 -37.54 78.12 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.616 0.366 . . . . 0.0 110.938 172.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.0 mm-40 . . . . . 0 N--CA 1.477 0.899 0 O-C-N 123.082 0.239 . . . . 0.0 111.265 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 . . . . . 0 N--CA 1.47 0.551 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.569 ' HB ' HD12 ' A' ' 43' ' ' LEU . 10.8 p -78.99 119.91 22.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.691 -173.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.71 123.6 18.83 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.099 1.36 . . . . 0.0 108.523 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 41' ' ' HIS . 17.8 mtm-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 119.1 -0.476 . . . . 0.0 109.934 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 121.002 0.429 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.93 127.34 38.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-O 121.041 0.448 . . . . 0.0 111.086 -177.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.26 162.98 20.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.838 0.855 . . . . 0.0 109.173 174.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.54 107.42 5.05 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.281 0.633 . . . . 0.0 110.491 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 9.6 m -75.93 154.09 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.382 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.52 -66.03 0.93 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 163.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.4 m -164.64 -162.34 0.64 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.156 1.782 . . . . 0.0 107.421 174.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -85.38 137.22 21.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 164.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.567 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.8 tmt_? -88.9 -54.3 4.2 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -137.17 163.94 29.67 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.503 0.721 . . . . 0.0 110.618 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -151.49 143.54 23.92 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.144 0.977 . . . . 0.0 108.483 -173.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -164.42 168.0 18.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.683 0.793 . . . . 0.0 110.179 -176.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 20' ' ' VAL . 21.8 t -116.0 125.29 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -123.54 94.9 4.38 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.295 1.038 . . . . 0.0 108.701 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.58 39.15 27.9 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.322 1.049 . . . . 0.0 111.353 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.93 -18.27 57.02 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.371 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -90.9 108.08 19.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.979 0.512 . . . . 0.0 109.688 -177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 15' ' ' VAL . 42.6 t -80.66 109.41 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -176.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 55.8 mt-10 -97.14 155.42 16.83 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.603 0.716 . . . . 0.0 110.864 -176.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.473 ' HB3' HD12 ' A' ' 10' ' ' ILE . 75.2 m-85 -134.65 109.81 8.88 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.102 177.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.15 87.73 0.11 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 63.1 t -74.24 118.75 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.567 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 22.6 tptm -80.19 124.84 29.15 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 36.9 m95 -103.89 134.89 46.43 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.09 -38.79 66.27 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -165.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.36 14.68 60.43 Favored Glycine 0 N--CA 1.474 1.172 0 CA-C-N 116.365 -0.38 . . . . 0.0 113.535 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 69.2 m95 -135.47 135.67 22.7 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 123.658 0.783 . . . . 0.0 110.003 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.99 164.75 21.05 Favored 'Trans proline' 0 CA--C 1.569 2.229 0 C-N-CA 122.971 2.447 . . . . 0.0 112.402 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.91 -13.47 27.32 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 123.793 2.996 . . . . 0.0 114.754 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.8 -23.62 63.36 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.696 0.399 . . . . 0.0 111.866 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -103.58 3.08 34.21 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.727 0.811 . . . . 0.0 112.294 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.4 p -71.21 129.62 39.37 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 169.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 p -118.75 128.27 54.33 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.094 0.558 . . . . 0.0 112.228 -165.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -71.18 101.52 2.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.517 0.727 . . . . 0.0 109.324 173.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -133.31 134.91 24.55 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.502 0.721 . . . . 0.0 109.059 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 68.7 Cg_endo -68.91 167.39 23.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.839 2.359 . . . . 0.0 113.831 -173.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.08 -21.85 0.8 Allowed 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 125.329 1.451 . . . . 0.0 114.59 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -54.73 -44.72 73.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.591 1.156 . . . . 0.0 111.53 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -83.11 -5.64 59.19 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.224 -172.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.543 HG21 HG23 ' A' ' 48' ' ' VAL . 28.5 mm -80.28 121.19 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.625 HD11 ' HG3' ' B' ' 8' ' ' ARG . 5.5 mp -88.09 -47.98 8.08 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.044 0.538 . . . . 0.0 109.606 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -100.51 130.83 24.82 Favored Pre-proline 0 CA--C 1.549 0.928 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.581 -169.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.33 -35.29 24.45 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 122.699 2.266 . . . . 0.0 113.183 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.452 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 56.5 mmm-85 -69.42 -16.15 63.44 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.179 0.592 . . . . 0.0 111.351 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.53 -47.05 80.26 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.238 0.615 . . . . 0.0 110.461 173.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 42' ' ' ILE . 67.5 t -73.58 -44.31 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.583 0.753 . . . . 0.0 110.577 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -67.1 -55.46 14.17 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.008 -171.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.26 -28.36 67.99 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.496 0.718 . . . . 0.0 112.558 -174.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -55.3 -49.92 70.9 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.915 0.886 . . . . 0.0 111.06 171.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 123.748 0.819 . . . . 0.0 111.605 -176.57 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.1 m -140.51 155.17 46.73 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 122.927 0.491 . . . . 0.0 110.122 -171.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.73 133.78 22.7 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.324 0.649 . . . . 0.0 111.365 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.625 ' HG3' HD11 ' A' ' 43' ' ' LEU . 94.7 mtt180 . . . . . 0 N--CA 1.489 1.498 0 C-N-CA 123.844 0.858 . . . . 0.0 110.125 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 . . . . . 0 N--CA 1.471 0.575 0 CA-C-O 121.336 0.589 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.463 HG11 HH11 ' B' ' 8' ' ' ARG . 35.2 m -97.06 127.58 49.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.963 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -130.15 148.53 52.0 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 124.088 0.955 . . . . 0.0 108.509 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.85 117.72 9.35 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.022 0.529 . . . . 0.0 109.627 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.447 HG12 ' CE3' ' A' ' 26' ' ' TRP . 11.2 m -99.64 150.79 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 123.171 0.588 . . . . 0.0 110.267 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.575 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 40.0 tt0 -73.62 -72.38 0.27 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -162.07 -176.42 5.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.141 1.377 . . . . 0.0 108.114 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.7 mm -71.3 124.49 27.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.492 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -76.97 -57.21 3.98 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.2 mttm -134.55 160.29 38.51 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.063 0.945 . . . . 0.0 110.421 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -145.61 134.49 22.47 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.91 0.884 . . . . 0.0 109.103 -166.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -167.24 176.58 6.66 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.213 0.605 . . . . 0.0 110.602 -178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -128.47 117.15 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -112.11 101.68 9.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.766 0.826 . . . . 0.0 109.299 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.5 tptp 52.99 53.12 12.54 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.61 1.164 . . . . 0.0 112.229 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.67 -17.06 58.68 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-N 115.324 -0.853 . . . . 0.0 114.066 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -91.82 118.75 30.99 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 174.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 98.3 t -83.49 102.49 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -105.93 138.59 41.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.979 0.512 . . . . 0.0 110.514 -167.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.479 ' HB3' HD12 ' A' ' 10' ' ' ILE . 22.2 m-85 -126.14 113.22 16.76 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.725 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.6 tp -64.62 100.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.975 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 164.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.48 HG21 ' CE1' ' A' ' 41' ' ' HIS . 95.3 t -100.69 129.22 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.27 109.89 19.82 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.125 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.447 ' CE3' HG12 ' A' ' 7' ' ' VAL . 27.1 m95 -83.64 106.79 15.64 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.575 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 63.4 pttt -69.26 -22.43 63.84 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -168.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.78 -36.89 92.83 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.561 0.538 . . . . 0.0 112.389 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -101.65 164.53 15.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.454 1.102 . . . . 0.0 109.48 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.69 152.64 64.68 Favored 'Trans proline' 0 CA--C 1.564 2.006 0 C-N-CA 121.612 1.541 . . . . 0.0 111.351 173.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -59.17 -8.82 7.01 Favored 'Trans proline' 0 C--N 1.388 2.639 0 C-N-CA 124.089 3.193 . . . . 0.0 115.775 -173.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -70.2 -12.72 61.79 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.05 0.386 . . . . 0.0 111.579 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -105.46 18.22 22.59 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.096 0.959 . . . . 0.0 111.286 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -68.76 116.98 9.88 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -109.81 140.48 43.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.293 0.637 . . . . 0.0 111.114 -174.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -75.46 87.33 2.61 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -102.59 127.94 29.2 Favored Pre-proline 0 CA--C 1.551 1.017 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.255 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 57.3 Cg_endo -66.66 159.31 51.68 Favored 'Trans proline' 0 C--N 1.383 2.343 0 C-N-CA 123.235 2.623 . . . . 0.0 112.545 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -58.95 -11.95 3.97 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -167.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.18 -33.57 69.39 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.307 1.043 . . . . 0.0 110.696 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.557 ' ND1' ' HB1' ' B' ' 7' ' ' ALA . 0.3 OUTLIER -79.76 -13.51 59.39 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -174.348 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mm -72.46 122.1 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.914 0.886 . . . . 0.0 110.515 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.7 mt -106.1 -0.92 24.34 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.773 0.429 . . . . 0.0 111.643 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -145.43 128.0 8.1 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 109.427 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -62.66 -43.72 20.18 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.627 2.218 . . . . 0.0 112.527 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.532 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 58.7 mtt180 -70.41 -15.48 62.84 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.833 0.853 . . . . 0.0 111.648 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.0 tp -53.63 -46.03 70.35 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.326 0.65 . . . . 0.0 110.213 168.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.82 -39.44 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 124.044 0.938 . . . . 0.0 111.317 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.532 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 20.2 mmt -71.68 -45.06 63.08 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.684 0.794 . . . . 0.0 111.874 -171.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.92 -26.91 65.33 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.506 0.722 . . . . 0.0 111.867 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -54.56 -44.2 72.7 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.123 0.569 . . . . 0.0 110.883 174.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 . . . . . 0 N--CA 1.476 0.856 0 C-N-CA 122.841 0.456 . . . . 0.0 111.671 -178.586 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.436 ' O ' HG22 ' A' ' 7' ' ' VAL . 19.4 mp0 . . . . . 0 C--O 1.239 0.548 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 m -121.61 150.09 42.21 Favored 'General case' 0 C--O 1.249 1.051 0 C-N-CA 123.832 0.853 . . . . 0.0 109.425 -174.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.557 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -156.34 147.0 21.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.279 0.632 . . . . 0.0 111.136 -175.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.463 HH11 HG11 ' A' ' 4' ' ' VAL . 2.2 mpt_? . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.478 0.711 . . . . 0.0 110.127 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.18 119.53 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -118.66 157.31 27.68 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.675 0.79 . . . . 0.0 109.625 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.51 123.86 21.99 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.054 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.598 HG21 HD13 ' A' ' 47' ' ' LEU . 12.4 m -97.1 153.28 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 123.696 0.798 . . . . 0.0 111.097 -173.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -81.95 -78.5 0.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 163.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.6 m -161.22 -173.75 4.0 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.997 1.319 . . . . 0.0 107.759 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.766 HD12 ' HB3' ' A' ' 22' ' ' TYR . 43.0 mm -81.09 115.72 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 169.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -57.68 6.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.123 0.969 . . . . 0.0 109.382 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.5 mttm -136.44 162.45 33.02 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.154 0.982 . . . . 0.0 110.008 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -146.58 141.09 26.6 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.706 0.803 . . . . 0.0 108.89 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -162.89 -176.57 4.99 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.687 1.195 . . . . 0.0 108.966 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 23.9 t -128.21 144.95 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -147.16 116.95 7.15 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt 65.73 28.74 10.95 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.563 1.145 . . . . 0.0 110.747 175.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.1 -12.97 58.76 Favored Glycine 0 C--N 1.352 1.455 0 CA-C-N 115.485 -0.779 . . . . 0.0 113.011 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -95.79 112.37 24.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.284 0.634 . . . . 0.0 109.639 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.0 t -70.41 119.95 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.451 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -94.0 142.35 27.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.514 0.725 . . . . 0.0 109.658 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.766 ' HB3' HD12 ' A' ' 10' ' ' ILE . 97.7 m-85 -130.4 108.08 9.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.284 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.431 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 44.1 tp -65.96 84.51 0.08 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.03 109.54 2.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -77.62 124.97 28.62 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 172.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m95 -97.84 136.53 38.03 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 28' ' ' GLY . 0.1 OUTLIER -65.25 -31.12 72.11 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -168.032 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.51 ' N ' ' HD3' ' A' ' 27' ' ' LYS . . . -97.78 2.56 60.33 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.946 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 33' ' ' TYR . 60.4 m95 -124.58 133.36 24.69 Favored Pre-proline 0 N--CA 1.471 0.61 0 C-N-CA 123.576 0.75 . . . . 0.0 109.647 -172.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.12 165.18 12.94 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.028 2.485 . . . . 0.0 112.277 174.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -57.53 -23.36 56.01 Favored 'Trans proline' 0 C--N 1.39 2.745 0 C-N-CA 123.254 2.636 . . . . 0.0 114.154 -176.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -13.33 61.35 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.13 0.572 . . . . 0.0 112.495 177.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 81.9 m-85 -113.86 1.39 14.76 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.585 0.754 . . . . 0.0 112.306 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.9 p -69.14 130.29 42.27 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 171.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.2 p -117.78 138.57 51.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.084 0.554 . . . . 0.0 111.404 -169.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -72.87 84.66 1.23 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.638 0.775 . . . . 0.0 109.087 176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -96.95 116.33 66.03 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.445 0.698 . . . . 0.0 109.131 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.72 176.2 4.55 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.464 2.109 . . . . 0.0 113.882 -175.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -50.41 -36.31 32.36 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.96 1.704 . . . . 0.0 113.212 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -60.84 -34.88 75.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.404 1.082 . . . . 0.0 112.382 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -83.37 -23.64 32.35 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.354 0.662 . . . . 0.0 112.258 -173.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.586 HG21 HG23 ' A' ' 48' ' ' VAL . 27.0 mm -71.93 108.45 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HB ' ' B' ' 6' ' ' THR . 4.6 pp -99.46 -24.5 14.76 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 117.667 0.212 . . . . 0.0 111.505 -173.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -104.11 120.54 50.64 Favored Pre-proline 0 N--CA 1.475 0.801 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -64.83 -20.12 64.53 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.3 2.0 . . . . 0.0 111.583 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -61.19 -20.51 62.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.835 1.254 . . . . 0.0 112.222 177.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.598 HD13 HG21 ' A' ' 7' ' ' VAL . 16.7 tp -71.72 -47.49 53.54 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.056 0.542 . . . . 0.0 111.164 178.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.586 HG23 HG21 ' A' ' 42' ' ' ILE . 78.8 t -77.67 -37.72 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.346 0.658 . . . . 0.0 110.682 179.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.6 mmt -67.08 -41.06 87.01 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.14 -178.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.91 70.31 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.278 0.561 . . . . 0.0 111.493 178.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -71.8 -53.24 13.97 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.231 1.013 . . . . 0.0 110.937 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 122.795 0.438 . . . . 0.0 111.236 -173.635 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.592 ' HB ' HD11 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -147.85 152.6 37.9 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.434 0.635 . . . . 0.0 111.692 -172.902 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.88 160.62 37.11 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.392 1.077 . . . . 0.0 109.494 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 . . . . . 0 C--O 1.238 0.466 0 C-N-CA 124.246 1.019 . . . . 0.0 109.198 175.781 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -96.79 140.88 16.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -130.26 142.03 50.58 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.264 0.626 . . . . 0.0 109.461 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 126.91 30.68 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.729 169.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.99 154.66 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.022 0.439 . . . . 0.0 111.565 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 42.9 tt0 -78.33 -63.57 1.37 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.946 172.343 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.6 m -165.56 173.39 10.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.681 1.192 . . . . 0.0 110.073 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.457 HD12 ' HB3' ' A' ' 22' ' ' TYR . 41.3 mm -85.11 126.59 40.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 162.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -52.79 6.26 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.99 170.04 16.7 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.829 0.852 . . . . 0.0 110.17 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -156.61 145.63 20.29 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.131 0.573 . . . . 0.0 110.094 -173.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -159.93 169.88 22.55 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.896 0.878 . . . . 0.0 109.208 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.41 115.91 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 166.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -137.0 126.45 25.04 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -174.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 65.46 24.95 11.91 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.016 0.913 . . . . 0.0 110.374 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.89 -9.05 47.31 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.282 -0.872 . . . . 0.0 113.18 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -93.92 111.43 23.14 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 123.988 0.915 . . . . 0.0 108.918 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.403 ' HB ' ' HG3' ' A' ' 39' ' ' GLU . 23.6 t -77.17 106.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -98.4 138.6 35.4 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 123.96 0.904 . . . . 0.0 110.288 -173.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 59.0 m-85 -122.61 117.25 25.39 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 tp -71.07 81.77 0.69 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.552 HG21 ' NE2' ' A' ' 41' ' ' HIS . 85.6 t -75.88 110.35 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.009 -169.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -75.39 107.44 7.51 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 52.7 m95 -75.78 147.83 38.93 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.093 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.6 OUTLIER -64.46 -54.49 31.79 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.164 0.586 . . . . 0.0 112.146 -169.192 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.81 13.19 64.0 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 116.207 -0.451 . . . . 0.0 113.796 -175.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 70.5 m95 -117.78 141.43 29.08 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 123.526 0.73 . . . . 0.0 109.772 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 41.3 Cg_endo -64.59 160.83 38.06 Favored 'Trans proline' 0 CA--C 1.563 1.932 0 C-N-CA 122.904 2.403 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.16 -20.37 46.13 Favored 'Trans proline' 0 C--N 1.389 2.659 0 C-N-CA 123.604 2.869 . . . . 0.0 115.184 -177.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -74.22 -19.81 60.39 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.412 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 39.3 m-85 -96.22 5.72 50.4 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.793 0.837 . . . . 0.0 111.897 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.9 p -68.36 117.85 10.68 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.7 p -106.06 144.29 32.99 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.503 0.721 . . . . 0.0 110.797 -173.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.04 80.03 1.71 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.051 0.929 . . . . 0.0 109.889 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -83.82 120.79 75.59 Favored Pre-proline 0 C--O 1.242 0.682 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.953 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.35 155.63 69.04 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 121.933 1.755 . . . . 0.0 111.428 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.403 ' HG3' ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -49.89 -19.89 0.78 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.686 1.595 . . . . 0.0 114.849 -177.332 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -55.35 -32.72 62.78 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.461 1.104 . . . . 0.0 112.854 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.604 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.8 p-80 -82.07 -12.22 58.37 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.89 120.63 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.935 0.894 . . . . 0.0 110.335 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.465 HD12 HG22 ' B' ' 6' ' ' THR . 38.0 mt -110.02 2.23 19.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.756 0.423 . . . . 0.0 110.985 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -150.89 127.19 5.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.328 0.651 . . . . 0.0 110.622 -174.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.32 -37.33 40.74 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.943 2.428 . . . . 0.0 112.199 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -64.81 -18.49 65.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.452 0.701 . . . . 0.0 111.478 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.87 -52.59 48.98 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.224 0.61 . . . . 0.0 111.314 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.05 -37.64 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-O 121.567 0.699 . . . . 0.0 110.075 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.6 mmt -70.98 -29.24 65.15 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.847 -178.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -30.56 70.76 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.007 0.432 . . . . 0.0 110.692 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -76.07 -56.29 4.79 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.543 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 N--CA 1.481 1.113 0 C-N-CA 123.079 0.551 . . . . 0.0 110.934 -171.621 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 pm0 . . . . . 0 CA--C 1.547 0.835 0 CA-C-O 121.802 0.811 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.465 HG22 HD12 ' A' ' 43' ' ' LEU . 13.0 m -117.87 150.99 38.27 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.913 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.604 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -151.56 129.53 11.77 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.976 -175.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 123.838 0.855 . . . . 0.0 110.792 172.545 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.44 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 1.8 mp0 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -105.35 130.37 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.44 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 37.3 m-85 -130.18 164.05 25.32 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.545 0.738 . . . . 0.0 109.747 179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.35 115.05 5.87 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.601 HG21 HD13 ' A' ' 47' ' ' LEU . 14.2 m -79.94 156.06 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 123.085 0.554 . . . . 0.0 110.242 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.586 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 37.1 tt0 -85.75 -67.93 0.77 Allowed 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 161.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 m -164.99 -167.79 1.29 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.157 1.383 . . . . 0.0 108.142 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.477 HD12 ' HB3' ' A' ' 22' ' ' TYR . 46.4 mm -91.93 133.2 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 163.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -88.22 -54.8 4.03 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.444 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 97.7 mttt -136.83 176.87 8.32 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.718 0.807 . . . . 0.0 110.583 -178.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -153.62 144.7 22.88 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -160.18 -175.04 4.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.923 0.889 . . . . 0.0 109.272 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.9 p -142.81 132.5 22.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 173.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -134.27 105.4 6.61 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.134 0.974 . . . . 0.0 109.101 -172.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.6 39.52 29.79 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.79 1.236 . . . . 0.0 111.566 -178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.92 -18.27 56.26 Favored Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.811 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -87.13 110.57 20.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 117.077 0.438 . . . . 0.0 110.764 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -75.06 110.15 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.603 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 34.8 mt-10 -101.11 146.69 27.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.472 0.709 . . . . 0.0 110.538 -173.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.9 m-85 -127.16 119.25 26.02 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.444 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 35.3 tp -70.46 82.84 0.58 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.97 107.19 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -176.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -77.58 118.94 20.47 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 40.1 m95 -92.61 149.43 21.35 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.586 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 3.5 tppp? -61.13 -51.61 68.35 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.189 0.996 . . . . 0.0 112.991 -167.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.93 6.53 76.63 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.61 -0.328 . . . . 0.0 113.576 -177.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 36.1 m95 -121.46 132.52 24.2 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.806 0.843 . . . . 0.0 109.632 -169.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 47.3 Cg_endo -66.03 165.96 22.32 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.974 2.449 . . . . 0.0 112.78 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.0 0.44 2.57 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 123.46 2.773 . . . . 0.0 115.207 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -91.88 -31.61 15.62 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 118.233 0.469 . . . . 0.0 111.077 168.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.448 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 49.4 m-85 -86.08 -1.75 57.68 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.461 0.705 . . . . 0.0 111.343 175.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.1 p -70.9 141.09 51.18 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 168.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.68 141.54 51.58 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.818 0.447 . . . . 0.0 111.935 -170.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -76.35 85.29 3.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.202 1.001 . . . . 0.0 110.282 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -95.22 114.63 64.2 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.513 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 71.9 Cg_exo -53.63 172.35 0.25 Allowed 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 123.653 2.902 . . . . 0.0 114.845 176.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.26 66.29 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.857 -176.348 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -70.72 -29.27 65.5 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.897 0.479 . . . . 0.0 111.352 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -77.22 -33.03 56.25 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.231 0.612 . . . . 0.0 110.624 177.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 36.0 mm -71.79 116.9 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.1 15.39 23.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.565 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -134.37 127.97 19.07 Favored Pre-proline 0 N--CA 1.476 0.829 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.24 -56.53 1.54 Allowed 'Trans proline' 0 C--N 1.378 2.094 0 C-N-CA 122.594 2.196 . . . . 0.0 112.183 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.514 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 84.6 mtt85 -69.54 -15.27 63.2 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.75 0.82 . . . . 0.0 112.993 -170.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 23.8 tp -56.94 -44.36 82.45 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-O 121.121 0.486 . . . . 0.0 110.126 169.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.563 HG23 HG21 ' A' ' 42' ' ' ILE . 53.8 t -84.25 -48.85 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.469 1.107 . . . . 0.0 111.122 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.514 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.7 mmt -62.41 -37.97 87.86 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.214 -170.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.94 -45.43 85.81 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.818 0.447 . . . . 0.0 111.137 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -54.41 -50.73 66.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.088 0.955 . . . . 0.0 111.445 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.149 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.9 p -141.85 159.61 41.87 Favored 'General case' 0 C--O 1.256 1.445 0 C-N-CA 123.902 0.881 . . . . 0.0 110.258 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.56 141.79 30.83 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.432 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 . . . . . 0 N--CA 1.471 0.578 0 C-N-CA 123.399 0.68 . . . . 0.0 109.406 179.03 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.468 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.4 m -131.1 98.41 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.754 1.222 . . . . 0.0 109.426 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.16 156.29 22.54 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.133 0.573 . . . . 0.0 111.372 -172.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.25 139.67 38.89 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.018 169.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.4 HG12 ' CE3' ' A' ' 26' ' ' TRP . 10.1 m -120.23 157.11 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.68 0.792 . . . . 0.0 110.646 -171.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 5.9 tp10 -61.5 -65.21 0.73 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 164.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.01 -179.52 4.69 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.479 1.112 . . . . 0.0 109.412 -179.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.8 mm -75.19 106.33 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 161.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.546 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -63.07 -54.01 44.65 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.366 0.667 . . . . 0.0 110.191 -178.104 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -138.62 172.96 12.11 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.408 0.683 . . . . 0.0 110.389 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -153.39 127.17 8.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.852 0.861 . . . . 0.0 108.779 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.87 178.43 9.16 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.357 0.663 . . . . 0.0 110.373 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.62 116.05 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.759 0.824 . . . . 0.0 108.962 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -131.53 121.65 24.81 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.6 tptt 65.62 26.41 11.57 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.518 1.127 . . . . 0.0 110.672 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.66 -13.39 58.7 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.821 -176.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -86.95 110.55 20.1 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.261 0.625 . . . . 0.0 109.483 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.9 t -77.79 107.24 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -104.05 136.14 44.25 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.901 0.481 . . . . 0.0 110.275 -172.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -113.92 121.06 42.79 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.546 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.9 tp -71.36 113.93 8.91 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG21 ' CE1' ' A' ' 41' ' ' HIS . 13.1 t -100.5 108.14 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -170.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -77.3 110.39 11.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.238 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 34' ' ' SER . 38.8 m95 -87.18 133.31 33.66 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 8' ' ' GLU . 2.9 tppp? -80.34 -50.08 10.65 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.346 0.658 . . . . 0.0 111.543 -172.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.75 -4.19 87.84 Favored Glycine 0 CA--C 1.54 1.65 0 N-CA-C 114.03 0.372 . . . . 0.0 114.03 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.5 m95 -120.28 149.43 49.53 Favored Pre-proline 0 N--CA 1.48 1.036 0 C-N-CA 124.247 1.019 . . . . 0.0 109.956 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.06 150.97 87.25 Favored 'Trans proline' 0 C--N 1.382 2.298 0 C-N-CA 122.685 2.257 . . . . 0.0 112.601 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -54.75 -30.39 66.87 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 124.507 3.472 . . . . 0.0 116.013 -167.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -73.02 -17.02 61.48 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -78.97 -1.36 34.98 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.909 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 57.0 m -67.12 116.51 8.0 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 174.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 p -97.97 141.24 31.18 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.138 0.975 . . . . 0.0 111.139 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -78.96 105.6 10.4 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 167.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.427 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 13.1 mm-40 -121.34 126.99 26.33 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.236 1.014 . . . . 0.0 109.402 -173.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -57.26 142.43 94.71 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 123.565 2.843 . . . . 0.0 111.87 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -54.4 -24.36 19.45 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -164.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.88 -24.81 67.99 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 124.265 1.026 . . . . 0.0 112.003 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.44 ' CE1' HG21 ' A' ' 24' ' ' VAL . 2.7 p80 -70.43 -19.49 62.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.458 0.703 . . . . 0.0 112.457 -174.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.605 HG23 HD23 ' A' ' 47' ' ' LEU . 36.8 mm -71.44 134.08 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.334 0.654 . . . . 0.0 109.432 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.496 HD12 ' HB ' ' B' ' 6' ' ' THR . 31.7 mt -100.15 5.12 44.81 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.154 0.582 . . . . 0.0 111.534 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 42' ' ' ILE . 32.5 t70 -151.13 125.34 4.48 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 122.757 0.423 . . . . 0.0 111.379 -174.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -64.55 -37.05 39.77 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.526 2.151 . . . . 0.0 112.699 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.448 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 88.8 mtt-85 -68.27 -15.12 63.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.487 0.715 . . . . 0.0 111.989 -175.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.605 HD23 HG23 ' A' ' 42' ' ' ILE . 12.0 tp -69.06 -52.51 27.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.384 0.674 . . . . 0.0 110.598 173.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.18 -33.43 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 121.594 0.711 . . . . 0.0 109.609 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.448 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 97.7 mmm -73.74 -29.38 62.2 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.971 176.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.3 -29.68 69.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.563 0.345 . . . . 0.0 110.347 174.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -71.7 -57.72 4.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.39 0.676 . . . . 0.0 110.709 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 . . . . . 0 N--CA 1.478 0.958 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.31 -168.694 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.7 mm100 . . . . . 0 N--CA 1.471 0.596 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.496 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.4 p -74.66 128.74 36.29 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.475 0.71 . . . . 0.0 111.119 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.45 134.85 36.29 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.468 ' HG2' HG12 ' A' ' 4' ' ' VAL . 97.0 mtt180 . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 121.822 0.82 . . . . 0.0 112.503 -177.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 . . . . . 0 CA--C 1.543 0.681 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.7 m -111.49 148.2 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.043 0.937 . . . . 0.0 110.58 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -146.78 164.07 33.97 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.816 0.847 . . . . 0.0 111.258 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.68 126.01 28.59 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.071 173.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 47' ' ' LEU . 35.8 m -104.95 151.45 7.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 124.051 0.94 . . . . 0.0 111.025 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -86.17 -70.52 0.59 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 168.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.8 m -162.4 -177.63 5.78 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 125.176 1.39 . . . . 0.0 108.544 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.6 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.1 mm -76.5 119.84 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 168.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.11 -50.89 36.14 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -142.67 158.15 43.95 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.78 0.832 . . . . 0.0 110.565 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -142.76 125.46 15.93 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.303 0.641 . . . . 0.0 109.824 -169.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -154.52 175.22 13.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.568 0.747 . . . . 0.0 109.546 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 11.5 p -118.31 142.94 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 171.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.455 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -150.57 120.87 7.31 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.805 0.842 . . . . 0.0 108.983 -176.264 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.455 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 27.7 mtpp 60.98 29.45 19.02 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.396 1.078 . . . . 0.0 111.747 178.342 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.3 -13.44 65.12 Favored Glycine 0 C--N 1.353 1.51 0 CA-C-N 116.091 -0.504 . . . . 0.0 113.457 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -103.72 117.6 34.77 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.729 0.811 . . . . 0.0 110.092 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 53.0 t -69.33 110.14 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.62 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 69.5 mt-10 -98.7 144.51 27.89 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.203 1.001 . . . . 0.0 110.477 -176.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.6 ' HB3' HD12 ' A' ' 10' ' ' ILE . 74.5 m-85 -126.78 116.95 21.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.726 -1.124 . . . . 0.0 108.573 -174.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.58 102.2 0.88 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 166.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -87.65 117.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -81.65 113.38 19.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 172.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -84.26 125.28 32.09 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -61.19 -43.1 99.42 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.482 0.713 . . . . 0.0 112.048 -169.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.78 4.55 83.54 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-O 119.609 -0.551 . . . . 0.0 114.177 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 39.0 m95 -120.99 143.12 36.11 Favored Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 123.499 0.72 . . . . 0.0 110.177 -178.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.37 152.13 82.71 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.93 2.42 . . . . 0.0 111.914 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.75 -34.1 5.46 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 124.893 3.729 . . . . 0.0 117.108 -171.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -69.98 -17.37 63.29 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.812 0.733 . . . . 0.0 112.816 -173.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -88.54 4.97 44.89 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.854 0.462 . . . . 0.0 111.713 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -64.15 124.25 21.18 Favored 'General case' 0 C--N 1.351 0.655 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.0 p -112.13 127.3 55.89 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.291 0.636 . . . . 0.0 112.009 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -75.88 78.91 2.78 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.789 0.835 . . . . 0.0 109.919 175.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -104.47 143.69 27.2 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.62 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 92.4 Cg_endo -77.97 176.72 9.66 Favored 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 122.264 1.976 . . . . 0.0 113.474 -172.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -48.21 -22.45 0.66 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.887 1.675 . . . . 0.0 113.816 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -56.61 -31.01 63.88 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.69 1.596 . . . . 0.0 113.289 175.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HD2' ' HB1' ' B' ' 7' ' ' ALA . 9.4 p-80 -87.13 -8.83 56.59 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.225 0.61 . . . . 0.0 112.359 -168.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 26.4 mm -80.18 122.69 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.124 0.569 . . . . 0.0 110.956 -171.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.578 HD11 ' HG3' ' B' ' 8' ' ' ARG . 6.8 mp -96.29 -15.97 21.63 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 177.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -150.94 130.46 6.6 Favored Pre-proline 0 N--CA 1.473 0.677 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -176.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.63 -25.35 54.56 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 123.162 2.575 . . . . 0.0 113.692 -173.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.12 -19.53 61.61 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.004 0.522 . . . . 0.0 111.546 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.478 HD13 HG21 ' A' ' 7' ' ' VAL . 10.7 tp -60.29 -47.21 87.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.881 0.472 . . . . 0.0 110.994 176.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.37 -46.65 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.512 0.725 . . . . 0.0 110.448 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -62.46 -54.26 42.71 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.762 -175.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.23 70.04 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.13 0.423 . . . . 0.0 111.692 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.17 -56.92 15.59 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.898 0.479 . . . . 0.0 109.955 172.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 123.178 0.591 . . . . 0.0 111.044 179.456 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.489 ' N ' HE21 ' B' ' 5' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 120.722 0.296 . . . . 0.0 110.632 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 10.9 m 70.05 138.59 0.04 OUTLIER 'General case' 0 C--O 1.253 1.287 0 C-N-CA 124.604 1.162 . . . . 0.0 112.231 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.635 ' HB1' ' HD2' ' A' ' 41' ' ' HIS . . . -146.37 135.39 22.57 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.334 -175.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG3' HD11 ' A' ' 43' ' ' LEU . 44.7 mtp180 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 166.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 112.05 -0.42 . . . . 0.0 112.05 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.93 150.79 20.84 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.016 0.527 . . . . 0.0 110.496 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -79.75 95.03 5.87 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.382 0.673 . . . . 0.0 110.252 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.6 m -124.77 142.51 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.651 0.78 . . . . 0.0 110.614 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -135.41 163.21 30.55 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.285 1.034 . . . . 0.0 109.173 176.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.03 105.72 3.43 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.4 0.68 . . . . 0.0 109.376 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.498 HG12 ' CZ3' ' A' ' 26' ' ' TRP . 1.6 m -87.56 154.13 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.906 -176.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -82.08 -79.99 0.17 Allowed 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.0 m -160.21 -174.04 4.33 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.517 1.127 . . . . 0.0 108.804 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.558 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.4 mm -80.88 134.72 26.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 172.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.73 4.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.902 0.881 . . . . 0.0 109.571 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -133.43 153.72 51.37 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.979 0.911 . . . . 0.0 109.306 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -135.73 135.32 39.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.7 ptm85 -162.47 173.36 14.15 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.606 0.762 . . . . 0.0 110.106 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 20' ' ' VAL . 14.4 t -119.34 119.9 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 175.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -118.93 110.75 17.52 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.985 0.914 . . . . 0.0 110.059 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp 60.55 31.5 20.26 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 124.287 1.035 . . . . 0.0 111.832 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.48 10.04 62.42 Favored Glycine 0 C--N 1.352 1.467 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.377 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -124.64 111.82 16.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.956 0.903 . . . . 0.0 109.98 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 15' ' ' VAL . 38.4 t -70.62 108.15 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.666 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 18.9 pt-20 -107.57 151.26 25.85 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.796 0.808 . . . . 0.0 110.696 -176.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.558 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -130.71 125.88 35.06 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.33 -173.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.8 tp -73.89 83.2 1.69 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.1 t -68.59 111.08 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -76.74 117.56 18.48 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.498 ' CZ3' HG12 ' A' ' 7' ' ' VAL . 26.6 m95 -90.46 121.1 32.12 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 176.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -70.43 -37.75 74.45 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -161.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.04 -10.99 84.21 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 116.523 -0.308 . . . . 0.0 113.268 177.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.409 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.8 m95 -108.43 148.99 38.75 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.618 1.167 . . . . 0.0 109.165 -177.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 56.9 Cg_endo -66.9 159.65 50.68 Favored 'Trans proline' 0 CA--C 1.559 1.742 0 C-N-CA 122.092 1.861 . . . . 0.0 111.141 177.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.93 -16.22 48.15 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.966 2.444 . . . . 0.0 113.449 -176.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -31.22 65.61 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.169 0.588 . . . . 0.0 111.694 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.41 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 29.2 m-85 -88.65 9.74 23.12 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.526 0.73 . . . . 0.0 111.802 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.7 m -75.33 132.39 40.94 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.7 p -121.4 168.25 11.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.621 0.768 . . . . 0.0 111.059 -172.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -97.39 95.18 7.5 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.253 0.621 . . . . 0.0 110.997 -175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -96.96 122.88 55.31 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 123.645 0.778 . . . . 0.0 109.327 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 59.4 Cg_endo -69.03 171.24 14.0 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.085 1.857 . . . . 0.0 112.291 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -27.17 44.66 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.143 0.977 . . . . 0.0 111.774 174.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.87 -34.9 70.25 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.47 1.508 . . . . 0.0 111.293 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -98.64 -19.76 17.36 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.187 0.995 . . . . 0.0 111.511 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.672 HG23 HD23 ' A' ' 47' ' ' LEU . 51.2 mm -71.35 114.42 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 123.024 0.53 . . . . 0.0 109.974 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.424 HD21 ' HD3' ' B' ' 8' ' ' ARG . 31.1 mt -83.65 -50.49 8.14 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.552 0.691 . . . . 0.0 110.14 -177.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -93.39 133.14 28.83 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.525 -166.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.26 -38.62 8.63 Favored 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.625 2.217 . . . . 0.0 112.201 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.503 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 47.6 mtm180 -69.82 -17.18 63.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.316 1.046 . . . . 0.0 111.119 -176.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.672 HD23 HG23 ' A' ' 42' ' ' ILE . 19.6 tp -59.21 -48.73 80.53 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 123.901 0.88 . . . . 0.0 111.142 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 80.7 t -84.46 -38.73 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.509 0.724 . . . . 0.0 110.675 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.503 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 57.7 mtt -64.94 -32.12 73.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.348 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.94 82.31 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.88 0.472 . . . . 0.0 109.862 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -58.84 -38.19 78.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.495 1.118 . . . . 0.0 111.718 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -97.98 -5.75 33.52 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 70.83 19.41 5.86 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.873 1.269 . . . . 0.0 112.739 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.49 6.44 37.73 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.761 0.824 . . . . 0.0 111.202 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -69.06 -26.2 64.84 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 168.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.007 170.944 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -97.43 104.79 16.84 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 7.8 t -104.27 137.53 42.04 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -73.85 114.98 12.76 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.475 ' O ' HG22 ' A' ' 7' ' ' VAL . 4.8 pm0 -54.13 143.49 22.33 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 124.359 1.037 . . . . 0.0 110.107 168.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 23.8 m -146.99 153.25 39.84 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.105 0.478 . . . . 0.0 111.903 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.07 148.6 42.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.863 1.265 . . . . 0.0 108.858 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.424 ' HD3' HD21 ' A' ' 43' ' ' LEU . 2.8 mpt_? -82.31 134.23 35.26 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 170.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.441 ' HG3' ' CZ2' ' A' ' 26' ' ' TRP . . . . . . . . 0 N--CA 1.475 0.822 0 CA-C-N 118.16 0.437 . . . . 0.0 111.981 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 17.6 t -72.21 83.57 1.03 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.725 0.774 . . . . 0.0 109.749 -178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 7.2 t -97.96 -7.44 30.05 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 114.42 -1.264 . . . . 0.0 110.074 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.98 -72.14 2.89 Favored Glycine 0 C--N 1.355 1.585 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.244 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 70.19 -154.32 52.52 Favored Glycine 0 C--N 1.347 1.191 0 CA-C-N 115.8 -0.2 . . . . 0.0 112.775 -178.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -84.38 116.03 22.83 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 O-C-N 123.835 0.709 . . . . 0.0 110.016 -176.453 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.477 1.399 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -105.75 -55.36 2.34 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.436 0.695 . . . . 0.0 111.238 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.6 mp0 -74.47 102.38 4.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.544 -170.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.15 126.84 52.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 123.775 0.83 . . . . 0.0 109.362 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 38.7 m-85 -131.0 152.74 49.99 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.297 0.639 . . . . 0.0 110.583 -177.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.15 107.72 1.65 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.311 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 HD13 ' A' ' 47' ' ' LEU . 20.3 m -90.85 155.88 3.05 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.314 1.046 . . . . 0.0 110.742 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -83.22 -74.01 0.38 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 161.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.6 m -161.4 -177.57 6.07 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.325 1.05 . . . . 0.0 109.628 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.6 mm -76.33 114.49 16.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 172.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.0 -51.48 38.85 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 123.343 0.657 . . . . 0.0 109.369 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -139.28 155.82 47.48 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.792 0.837 . . . . 0.0 110.355 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -146.12 134.33 21.69 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.093 0.957 . . . . 0.0 109.071 -175.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.439 HH21 ' HB2' ' A' ' 16' ' ' ARG . 7.2 ptm180 -163.21 -174.55 3.87 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.708 1.203 . . . . 0.0 109.465 -173.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -136.66 139.73 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.541 0.736 . . . . 0.0 109.18 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' HH21 ' A' ' 14' ' ' ARG . 22.3 tpt180 -141.72 132.24 25.34 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt 59.49 26.12 15.02 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.599 1.16 . . . . 0.0 112.102 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.05 23.71 73.71 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.414 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -125.68 120.87 31.87 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.641 0.776 . . . . 0.0 109.288 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 28.1 t -73.88 112.96 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.293 0.637 . . . . 0.0 110.348 -174.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -96.86 147.87 23.51 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.493 0.717 . . . . 0.0 110.604 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HB2' ' HE1' ' A' ' 41' ' ' HIS . 90.9 m-85 -132.4 112.35 12.09 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.989 0.916 . . . . 0.0 109.735 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.98 101.0 3.1 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 164.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 88.3 t -93.36 123.61 45.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-O 121.054 0.454 . . . . 0.0 110.321 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -83.98 107.76 16.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.821 172.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 9.1 m95 -83.19 119.05 24.06 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 174.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -69.17 -28.33 66.32 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.269 0.486 . . . . 0.0 111.816 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.39 -23.18 77.66 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.595 -0.275 . . . . 0.0 113.283 175.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 15.0 m95 -107.97 139.37 20.6 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.211 1.004 . . . . 0.0 109.54 -174.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -62.31 156.36 51.57 Favored 'Trans proline' 0 CA--C 1.563 1.964 0 C-N-CA 122.469 2.113 . . . . 0.0 111.86 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.79 -26.48 17.83 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.92 3.08 . . . . 0.0 115.427 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -67.44 -14.29 62.8 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -111.27 18.55 19.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.984 0.914 . . . . 0.0 111.692 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 p -68.69 123.18 20.2 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.0 p -121.28 167.15 13.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.272 0.629 . . . . 0.0 111.588 -172.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -111.16 121.73 46.06 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.204 1.002 . . . . 0.0 109.394 -173.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' B' ' 9' ' ' M3L . 7.2 mp0 -129.54 146.44 61.08 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -75.76 174.79 12.22 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.127 1.885 . . . . 0.0 112.701 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 10.8 pt-20 -49.58 -28.28 5.49 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 126.308 1.843 . . . . 0.0 114.613 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.76 -33.7 61.59 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.881 1.272 . . . . 0.0 112.44 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 3.4 p-80 -81.67 -18.83 43.17 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -168.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.7 mm -72.87 113.57 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.95 0.5 . . . . 0.0 109.681 -176.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -88.38 -33.56 17.88 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.98 0.419 . . . . 0.0 110.634 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.455 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 13.6 t70 -119.69 130.64 24.74 Favored Pre-proline 0 N--CA 1.48 1.043 0 C-N-CA 123.822 0.849 . . . . 0.0 110.709 -174.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.95 -36.08 40.48 Favored 'Trans proline' 0 C--N 1.381 2.271 0 C-N-CA 123.066 2.511 . . . . 0.0 113.008 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -65.37 -23.55 67.01 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.06 0.544 . . . . 0.0 111.05 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.402 HD13 HG21 ' A' ' 7' ' ' VAL . 34.6 tp -56.7 -52.37 65.21 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.652 0.781 . . . . 0.0 111.202 173.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.7 t -71.83 -51.86 29.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.846 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 23.1 mmt -62.09 -28.46 69.63 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.409 -1.269 . . . . 0.0 112.667 -172.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.87 -44.79 92.01 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 121.289 0.566 . . . . 0.0 111.002 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -72.11 -36.85 69.55 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.324 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -68.38 -35.31 77.52 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.441 0.296 . . . . 0.0 111.185 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.644 ' HG3' ' HD3' ' A' ' 54' ' ' LYS . 17.9 pt-20 -79.1 -37.12 39.53 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.363 0.265 . . . . 0.0 110.813 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.644 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 3.8 mppt? -89.33 -163.48 1.0 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.374 0.67 . . . . 0.0 109.268 170.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -144.22 131.71 21.0 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.916 0.486 . . . . 0.0 110.018 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 CA--C 1.559 1.295 0 C-N-CA 125.829 1.652 . . . . 0.0 112.367 176.839 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -87.17 91.1 8.6 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.271 0.629 . . . . 0.0 110.949 177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 31.3 m 64.38 104.81 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.815 1.246 . . . . 0.0 111.868 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -160.08 81.55 0.7 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.679 0.792 . . . . 0.0 109.047 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 3.0 mp0 52.16 23.79 2.47 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.128 0.971 . . . . 0.0 112.629 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -65.47 145.04 56.62 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 123.695 0.798 . . . . 0.0 111.59 -172.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -137.72 116.69 12.43 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.143 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 41.6 mtm180 -75.59 153.9 37.05 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.493 175.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.478 ' HA ' ' HG2' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.476 0.83 0 O-C-N 121.512 -0.743 . . . . 0.0 110.143 174.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.9 t -63.71 89.95 0.05 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.028 0.931 . . . . 0.0 111.417 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 73.4 p -132.61 163.0 29.87 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.059 0.943 . . . . 0.0 110.136 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.04 -38.2 0.6 Allowed Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.874 -0.491 . . . . 0.0 111.874 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 156.62 -54.03 0.41 Allowed Glycine 0 C--N 1.339 0.717 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -139.38 146.92 40.78 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 0.0 110.219 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 166.785 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 CA-C-O 120.109 -0.273 . . . . 0.0 112.798 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -87.27 -178.34 6.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.02 0.528 . . . . 0.0 110.712 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -88.37 90.46 8.41 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 122.889 0.476 . . . . 0.0 111.31 -168.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' B' ' 8' ' ' ARG . 33.4 m -132.07 142.42 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 123.683 0.793 . . . . 0.0 109.821 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.423 ' CD1' ' HE2' ' B' ' 9' ' ' M3L . 33.9 m-85 -135.53 160.29 38.93 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.044 0.938 . . . . 0.0 110.218 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.73 114.81 4.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.528 0.731 . . . . 0.0 109.927 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.6 m -80.02 153.0 4.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.187 0.518 . . . . 0.0 110.698 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 37.3 tt0 -94.19 -62.33 1.36 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.58 -172.79 2.0 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.528 1.531 . . . . 0.0 108.559 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 mm -91.92 139.45 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 164.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -50.28 4.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.457 0.703 . . . . 0.0 109.916 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -137.55 171.26 14.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.385 0.674 . . . . 0.0 110.603 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.72 134.2 15.39 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -173.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -155.67 -178.0 6.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.987 0.915 . . . . 0.0 110.047 -174.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.97 139.57 33.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 108.805 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -149.83 108.97 3.92 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.134 0.973 . . . . 0.0 108.844 -170.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm 59.99 32.36 21.07 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.243 1.017 . . . . 0.0 111.242 -177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.66 -17.83 56.77 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 115.27 -0.877 . . . . 0.0 113.55 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.88 111.95 21.98 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.043 0.537 . . . . 0.0 110.481 -177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.09 110.48 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 177.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -103.61 148.47 25.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.456 1.102 . . . . 0.0 109.833 -172.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -128.77 123.75 33.73 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -71.7 83.12 0.87 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -65.74 105.93 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.6 112.78 14.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 37.0 m95 -83.89 147.48 27.49 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 177.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 87.9 tttt -62.77 -53.86 47.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.714 0.806 . . . . 0.0 112.33 -166.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.57 1.12 83.67 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 54.5 m95 -116.86 134.99 22.9 Favored Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 123.218 0.607 . . . . 0.0 110.812 -171.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.99 167.68 25.35 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 123.276 2.651 . . . . 0.0 112.712 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -51.45 -28.63 28.49 Favored 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 123.855 3.037 . . . . 0.0 115.34 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -72.73 -28.4 62.63 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.494 0.318 . . . . 0.0 111.318 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -102.86 11.27 37.71 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.49 0.716 . . . . 0.0 111.069 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.443 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.7 m -86.97 137.34 32.44 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 167.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.3 p -110.94 139.22 46.47 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.366 0.666 . . . . 0.0 110.918 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.81 76.32 5.3 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.726 0.811 . . . . 0.0 110.031 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -91.48 122.37 66.02 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 123.55 0.74 . . . . 0.0 109.218 -178.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 19.1 Cg_exo -68.76 174.98 7.82 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.732 2.288 . . . . 0.0 112.95 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.69 -15.58 30.43 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.77 1.228 . . . . 0.0 112.268 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' A' ' 38' ' ' PRO . 40.6 mm-40 -55.35 -42.97 74.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.734 1.214 . . . . 0.0 110.922 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -105.13 -9.56 17.7 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.765 -171.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.584 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -71.92 112.24 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.596 HD12 ' HB ' ' B' ' 6' ' ' THR . 35.6 mt -71.07 -21.73 62.2 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -172.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -143.55 128.09 9.53 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 122.825 0.45 . . . . 0.0 110.198 -169.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.48 -35.11 98.89 Favored 'Trans proline' 0 C--N 1.38 2.19 0 C-N-CA 122.79 2.327 . . . . 0.0 112.91 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -67.57 -20.29 65.37 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.693 0.397 . . . . 0.0 111.839 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.584 HD23 HG23 ' A' ' 42' ' ' ILE . 24.0 tp -57.39 -42.78 82.89 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.054 0.388 . . . . 0.0 110.423 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 48.8 t -87.81 -46.74 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.663 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtt -63.7 -46.93 83.24 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.764 0.825 . . . . 0.0 112.53 -172.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.58 -33.44 75.61 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 123.642 0.589 . . . . 0.0 110.683 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.36 -48.47 81.62 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.507 0.504 . . . . 0.0 110.445 169.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' VAL . 46.2 mt-10 -71.71 -7.73 49.81 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -173.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -69.22 -26.18 64.68 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.987 0.515 . . . . 0.0 111.411 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.547 ' HE2' ' HB3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -158.65 153.92 25.6 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.897 0.479 . . . . 0.0 110.379 -175.548 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -77.64 83.21 4.03 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.299 0.571 . . . . 0.0 110.091 176.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HB3' ' HE2' ' A' ' 54' ' ' LYS . 9.6 tp10 . . . . . 0 CA--C 1.548 0.893 0 C-N-CA 124.618 1.167 . . . . 0.0 107.962 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 110.478 -0.193 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -82.93 -5.56 59.1 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.478 0.711 . . . . 0.0 111.3 174.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.2 t -80.66 121.33 25.73 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.388 0.675 . . . . 0.0 110.691 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -127.09 115.89 19.85 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.433 1.093 . . . . 0.0 108.171 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.522 ' HG3' ' HB2' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -126.27 169.25 13.08 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.692 0.797 . . . . 0.0 111.401 -175.104 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.596 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.0 m -148.86 162.08 40.56 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.899 1.28 . . . . 0.0 108.629 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.74 150.52 47.65 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.559 ' HA ' HG12 ' A' ' 4' ' ' VAL . 12.0 mmm-85 -95.98 119.96 35.4 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.423 ' HE2' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.242 0.662 0 CA-C-N 118.066 0.394 . . . . 0.0 110.126 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 32.6 t -66.87 84.56 0.12 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 124.005 0.816 . . . . 0.0 109.453 175.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -84.69 145.13 28.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.323 -177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.17 168.4 28.07 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.297 -176.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.9 76.65 0.22 Allowed Glycine 0 C--N 1.34 0.769 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -87.48 124.74 33.77 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.42 0.688 . . . . 0.0 110.752 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.183 0 C-N-CA 124.263 1.025 . . . . 0.0 109.084 -179.061 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.386 0 N-CA-C 112.386 -0.286 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.27 162.42 41.18 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.592 1.157 . . . . 0.0 108.383 179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -142.72 131.27 22.46 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-O 121.07 0.462 . . . . 0.0 110.862 173.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.1 m -99.82 152.3 4.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.386 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -131.19 143.94 50.97 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.859 0.463 . . . . 0.0 110.172 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.19 110.21 4.46 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.175 175.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 18.5 m -97.13 154.56 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.768 0.427 . . . . 0.0 111.295 -172.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 36.1 tt0 -81.08 -69.83 0.58 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 170.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.9 m -166.21 -177.6 4.2 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.836 1.254 . . . . 0.0 109.487 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.9 mm -76.61 142.46 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 167.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.2 -46.69 4.36 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -143.04 165.07 28.38 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.489 1.116 . . . . 0.0 109.928 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -153.69 128.67 9.58 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.783 0.833 . . . . 0.0 108.775 -169.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.409 HH12 ' HD3' ' A' ' 16' ' ' ARG . 3.8 ptm180 -155.85 -174.3 4.9 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.218 1.007 . . . . 0.0 109.467 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -135.59 129.81 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HD3' HH12 ' A' ' 14' ' ' ARG . 54.2 ttp85 -133.74 119.39 19.23 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.151 0.98 . . . . 0.0 109.157 -178.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.86 27.76 16.13 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.403 1.081 . . . . 0.0 111.52 177.023 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.16 10.87 79.65 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.442 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 111.99 23.23 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 70.6 t -70.93 109.88 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -96.62 145.17 25.98 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.432 0.634 . . . . 0.0 110.095 -171.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.442 ' HB3' HD12 ' A' ' 10' ' ' ILE . 96.5 m-85 -127.21 111.49 14.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.589 -1.187 . . . . 0.0 107.869 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 tp -66.61 81.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 167.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.411 HG21 ' NE2' ' A' ' 41' ' ' HIS . 95.6 t -77.37 116.15 20.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -78.05 111.2 13.71 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 170.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 5.6 m95 -85.3 140.53 30.75 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 4.3 tppp? -58.0 -57.36 13.14 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -168.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.44 1.39 88.87 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.924 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 61.8 m95 -115.15 128.2 26.15 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.421 0.689 . . . . 0.0 109.918 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.72 175.67 6.92 Favored 'Trans proline' 0 CA--C 1.572 2.416 0 C-N-CA 123.32 2.68 . . . . 0.0 112.905 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -65.11 -13.36 39.37 Favored 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.607 2.204 . . . . 0.0 114.614 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -79.99 -8.72 59.5 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 122.187 -0.321 . . . . 0.0 111.423 173.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -114.9 -8.74 12.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.982 0.913 . . . . 0.0 111.778 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.6 p -64.25 117.02 6.59 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 169.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.5 p -122.87 148.2 45.7 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.958 0.409 . . . . 0.0 111.745 -169.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.74 87.46 4.64 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.646 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -102.51 133.74 20.34 Favored Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.25 166.57 26.5 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.236 2.624 . . . . 0.0 114.135 -171.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 12.4 pt-20 -49.58 -29.82 7.65 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.469 1.907 . . . . 0.0 114.785 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.24 -45.49 91.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.723 0.809 . . . . 0.0 111.55 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.53 ' HB2' ' HB2' ' B' ' 8' ' ' ARG . 2.1 p-80 -62.74 -17.22 60.51 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -172.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.69 111.69 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.315 0.646 . . . . 0.0 109.825 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.589 HD21 ' HG2' ' B' ' 8' ' ' ARG . 53.8 mt -81.8 -15.25 54.81 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 120.908 0.385 . . . . 0.0 111.453 -176.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -144.87 119.7 5.8 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 123.431 0.692 . . . . 0.0 109.662 -164.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.22 -34.19 79.19 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 122.584 2.189 . . . . 0.0 112.269 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.5 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.9 mtt85 -65.77 -20.11 66.14 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.174 0.99 . . . . 0.0 110.774 -173.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.1 tp -59.47 -52.03 67.34 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.444 1.098 . . . . 0.0 111.272 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 39.4 t -78.85 -35.0 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.299 0.639 . . . . 0.0 109.915 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.5 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.6 mmt -68.5 -28.83 67.36 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.526 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.9 -30.56 56.23 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 122.882 0.473 . . . . 0.0 111.328 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -61.03 -50.53 72.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.138 0.575 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -87.17 -11.75 48.98 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.809 0.844 . . . . 0.0 111.53 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 61.06 37.56 17.79 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.75 1.22 . . . . 0.0 111.006 -177.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -68.83 108.7 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.089 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.69 -9.1 45.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.853 0.861 . . . . 0.0 111.14 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 123.749 0.82 . . . . 0.0 109.574 -176.945 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 120.724 0.297 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 140.34 40.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.809 0.844 . . . . 0.0 109.752 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 42.2 p -70.82 153.21 42.94 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.514 0.509 . . . . 0.0 110.421 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -83.19 90.12 7.05 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.401 ' O ' HG22 ' A' ' 7' ' ' VAL . 2.1 mp0 -64.3 98.01 0.21 Allowed 'General case' 0 C--N 1.348 0.541 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 163.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -139.93 162.31 35.48 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 124.338 1.055 . . . . 0.0 109.813 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.519 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.78 141.66 24.71 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.831 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.589 ' HG2' HD21 ' A' ' 43' ' ' LEU . 19.5 mmt85 -69.85 179.05 2.37 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.906 0.883 . . . . 0.0 111.849 177.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.799 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.236 160.228 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.7 t -57.85 -35.09 70.44 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.206 0.602 . . . . 0.0 110.759 173.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m 61.58 18.23 9.3 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 124.87 1.268 . . . . 0.0 110.706 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 -97.85 2.26 Favored Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.014 -1.235 . . . . 0.0 110.014 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.58 97.45 0.07 OUTLIER Glycine 0 C--N 1.35 1.337 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 63.23 20.93 12.56 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.452 1.101 . . . . 0.0 111.525 -172.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 C-N-CA 124.39 1.076 . . . . 0.0 108.32 179.67 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.63 0 N-CA-C 112.298 -0.321 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.517 ' HA ' HG22 ' B' ' 11' ' ' THR . 46.9 mt-10 -77.97 74.66 4.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.764 0.793 . . . . 0.0 109.659 176.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.444 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 85.5 mt-30 -88.41 117.87 27.64 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.012 -171.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.5 m -112.0 123.85 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.771 0.828 . . . . 0.0 109.152 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 21.8 m-85 -124.79 162.78 23.54 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.641 0.776 . . . . 0.0 109.588 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.87 112.78 4.47 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.334 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.54 HG21 HD13 ' A' ' 47' ' ' LEU . 32.7 m -74.55 154.34 6.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.283 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.7 tp10 -89.24 -64.96 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 166.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.2 m -165.01 175.2 9.68 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.827 1.251 . . . . 0.0 108.685 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.52 HD11 ' HG ' ' A' ' 47' ' ' LEU . 41.3 mm -78.95 117.71 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 162.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.525 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -72.46 -56.49 5.33 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.525 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.1 mttm -132.76 161.74 33.29 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.411 0.684 . . . . 0.0 110.956 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -146.54 136.55 23.46 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.414 1.085 . . . . 0.0 108.4 -176.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -159.79 177.55 10.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.045 0.538 . . . . 0.0 110.303 -173.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 20' ' ' VAL . 22.2 t -130.15 118.27 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 169.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.495 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 13.8 tpt85 -146.12 137.9 24.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.354 1.062 . . . . 0.0 108.895 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mtmt 64.99 25.05 12.68 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.278 1.031 . . . . 0.0 111.095 -178.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.05 4.83 84.14 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.876 -0.602 . . . . 0.0 113.411 -175.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -116.49 130.82 56.96 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.963 0.905 . . . . 0.0 110.312 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 15' ' ' VAL . 46.3 t -79.23 108.29 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 39.0 mt-10 -101.16 147.26 26.45 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.151 0.581 . . . . 0.0 110.356 -171.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -129.04 123.13 31.53 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.058 0.943 . . . . 0.0 108.902 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.6 tp -76.12 88.07 3.02 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 167.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.5 HG21 ' NE2' ' A' ' 41' ' ' HIS . 91.9 t -78.13 111.3 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.082 0.553 . . . . 0.0 110.116 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 4.9 tmtm? -83.18 132.4 35.07 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -106.36 135.2 48.26 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 19.9 ttmm -56.27 -59.97 4.18 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -165.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.27 17.98 25.69 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.437 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -122.92 134.7 25.2 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.211 1.004 . . . . 0.0 109.542 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -56.27 155.85 23.24 Favored 'Trans proline' 0 CA--C 1.567 2.125 0 C-N-CA 123.464 2.776 . . . . 0.0 113.378 -177.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -47.34 -38.27 26.25 Favored 'Trans proline' 0 C--N 1.383 2.376 0 C-N-CA 124.357 3.371 . . . . 0.0 116.029 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -81.8 -9.05 59.73 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -91.95 10.25 29.67 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.71 0.804 . . . . 0.0 111.53 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.8 m -71.2 137.9 49.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 169.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 p -119.78 147.52 44.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.863 0.465 . . . . 0.0 111.43 -171.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -94.43 119.59 33.38 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.962 0.905 . . . . 0.0 110.213 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -138.73 147.53 54.87 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 123.204 0.602 . . . . 0.0 109.631 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 16.0 Cg_exo -65.31 177.73 2.44 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 123.251 2.634 . . . . 0.0 113.12 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.54 -15.88 59.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.794 0.838 . . . . 0.0 112.587 -178.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.82 -23.76 66.75 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.847 1.259 . . . . 0.0 112.766 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.585 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 1.6 p-80 -89.37 -7.26 55.61 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.1 mm -71.08 112.93 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.559 0.744 . . . . 0.0 110.423 -175.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.6 mt -90.28 -10.82 42.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.013 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -150.69 131.01 6.97 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.637 -174.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -61.17 -33.0 91.47 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.174 2.583 . . . . 0.0 113.049 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 39.0 mmt180 -65.32 -15.73 62.84 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.381 0.672 . . . . 0.0 112.092 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.567 ' HB2' ' HB3' ' B' ' 5' ' ' GLN . 14.1 tp -64.57 -48.25 75.69 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.043 0.537 . . . . 0.0 110.737 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.32 -32.71 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.301 0.64 . . . . 0.0 110.251 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.595 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 52.7 mtt -61.57 -48.96 78.58 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.189 0.995 . . . . 0.0 111.396 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.74 -28.46 69.9 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.392 0.677 . . . . 0.0 111.475 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.87 -55.62 16.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.701 0.401 . . . . 0.0 110.984 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.93 -27.9 35.98 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.714 -170.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -116.08 40.09 2.91 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.6 1.16 . . . . 0.0 109.86 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.475 ' HG2' ' HB3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -61.94 166.23 4.75 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 114.361 -1.29 . . . . 0.0 113.114 177.315 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -18.99 65.71 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.471 1.108 . . . . 0.0 112.233 -178.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB3' ' HG2' ' A' ' 54' ' ' LYS . 14.4 tp10 . . . . . 0 CA--C 1.555 1.165 0 C-N-CA 124.103 0.961 . . . . 0.0 110.374 174.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -93.12 -32.5 14.41 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.676 0.79 . . . . 0.0 110.442 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.43 HG21 ' HE3' ' A' ' 27' ' ' LYS . 44.8 p 61.2 11.03 3.28 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 126.143 1.777 . . . . 0.0 114.159 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -81.67 -4.83 57.24 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.1 0.96 . . . . 0.0 110.276 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.567 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.8 mp0 -70.69 72.27 0.52 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.425 1.49 . . . . 0.0 110.408 178.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 p -82.42 172.37 13.13 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 -170.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -162.8 133.6 4.79 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.859 -169.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -72.67 121.4 19.73 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.834 0.454 . . . . 0.0 110.075 175.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.004 0 CA-C-N 118.033 0.379 . . . . 0.0 111.432 172.376 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 16.8 p -59.05 95.19 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 171.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.517 HG22 ' HA ' ' A' ' 2' ' ' GLU . 71.0 p -61.27 -34.5 75.27 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.558 1.143 . . . . 0.0 112.031 -169.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -122.1 58.59 0.59 Allowed Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 171.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.57 141.59 37.13 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 112.007 -0.437 . . . . 0.0 112.007 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.81 114.61 10.61 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.287 0.635 . . . . 0.0 110.643 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.17 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 174.509 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -79.78 83.2 5.76 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.34 0.656 . . . . 0.0 109.731 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -77.96 99.34 6.01 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.702 -174.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -97.92 153.38 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.987 0.915 . . . . 0.0 111.351 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.524 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 54.6 m-85 -137.46 156.77 47.78 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.568 1.147 . . . . 0.0 108.152 171.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 27' ' ' LYS . . . -68.81 125.67 27.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.35 0.66 . . . . 0.0 110.522 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.14 154.06 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.377 0.671 . . . . 0.0 110.25 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 12.7 tp10 -83.82 -69.52 0.63 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.4 m -158.86 -161.14 0.93 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.977 1.311 . . . . 0.0 108.16 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.449 HG23 ' HB3' ' A' ' 22' ' ' TYR . 48.1 mm -90.71 121.7 41.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.025 0.53 . . . . 0.0 109.98 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -77.41 -55.03 5.73 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.097 0.959 . . . . 0.0 109.836 -179.572 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -135.51 171.64 14.15 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.214 0.606 . . . . 0.0 110.552 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -155.81 143.31 19.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.023 0.529 . . . . 0.0 110.587 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -165.56 163.1 19.41 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.373 1.069 . . . . 0.0 108.556 175.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 14.0 p -101.31 137.82 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 168.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -153.39 127.99 9.37 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.292 0.637 . . . . 0.0 109.552 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.7 tptt 65.52 26.26 11.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.748 1.219 . . . . 0.0 111.077 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.82 3.71 90.44 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.524 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -119.27 119.16 33.24 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.759 0.824 . . . . 0.0 109.598 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 34.6 t -71.01 107.49 2.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 176.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 9.1 pt-20 -100.16 137.92 37.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.993 0.917 . . . . 0.0 109.72 -177.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.449 ' HB3' HG23 ' A' ' 10' ' ' ILE . 42.4 m-85 -116.75 123.19 46.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.115 -1.402 . . . . 0.0 107.838 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 tp -67.25 88.18 0.18 Allowed 'General case' 0 C--N 1.347 0.475 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 165.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.86 126.37 31.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 28.1 tptp -77.49 99.86 5.83 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.524 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 62.0 m95 -75.08 105.02 5.89 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 173.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HE2' ' HB1' ' A' ' 6' ' ' ALA . 65.5 pttt -70.31 -20.01 63.04 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -162.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.25 -13.06 79.85 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 123.002 0.189 . . . . 0.0 112.653 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -125.17 152.65 71.13 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 109.735 -170.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.03 165.1 33.49 Favored 'Trans proline' 0 CA--C 1.567 2.127 0 C-N-CA 122.455 2.103 . . . . 0.0 111.603 172.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.79 -20.64 69.92 Favored 'Trans proline' 0 C--N 1.391 2.804 0 C-N-CA 123.214 2.609 . . . . 0.0 113.793 -174.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -80.2 -29.16 38.57 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.391 0.277 . . . . 0.0 111.6 176.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -87.69 -6.49 58.2 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.044 0.538 . . . . 0.0 110.745 173.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' HD1' ' A' ' 26' ' ' TRP . 49.1 m -78.55 157.91 28.67 Favored 'General case' 0 C--N 1.353 0.754 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.432 ' OG1' HM22 ' B' ' 9' ' ' M3L . 3.2 m -139.37 155.18 47.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 120.612 0.244 . . . . 0.0 111.601 -164.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -87.27 92.25 9.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.2 1.0 . . . . 0.0 111.129 -175.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 8' ' ' ARG . 5.3 mp0 -104.78 121.49 46.66 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 124.243 1.017 . . . . 0.0 109.976 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 35.5 Cg_exo -61.44 174.42 2.1 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.933 2.422 . . . . 0.0 114.121 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.33 -13.81 61.11 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.546 -175.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -25.58 53.15 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.233 0.213 . . . . 0.0 111.377 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -80.04 -25.07 40.3 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.533 0.733 . . . . 0.0 111.4 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.643 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -68.37 127.82 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.045 0.938 . . . . 0.0 110.46 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.624 HD12 ' HB ' ' B' ' 6' ' ' THR . 56.9 mt -77.15 -64.09 1.22 Allowed 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.106 0.479 . . . . 0.0 110.956 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -100.65 133.5 21.18 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.498 -172.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -59.56 -30.82 93.33 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 123.219 2.613 . . . . 0.0 113.343 -175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.458 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 67.7 mtp180 -69.48 -16.04 63.38 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.58 0.752 . . . . 0.0 112.045 -176.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.643 HD23 HG23 ' A' ' 42' ' ' ILE . 20.2 tp -59.93 -43.57 94.87 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 120.968 0.413 . . . . 0.0 110.642 172.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 77.3 t -82.74 -48.89 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.417 175.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.458 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -65.66 -31.69 72.84 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.645 1.178 . . . . 0.0 113.303 -169.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.25 -37.46 69.12 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.829 0.347 . . . . 0.0 110.884 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -66.13 -39.16 89.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.507 0.723 . . . . 0.0 110.344 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -76.06 -19.52 58.52 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.683 0.793 . . . . 0.0 111.836 178.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 63.2 19.62 11.78 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.531 1.133 . . . . 0.0 110.851 -169.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.74 115.24 27.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.584 1.154 . . . . 0.0 110.547 -172.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -77.61 111.28 13.21 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 CA--C 1.568 1.656 0 C-N-CA 126.67 1.988 . . . . 0.0 113.844 -173.262 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -84.5 94.82 8.64 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.581 0.753 . . . . 0.0 110.079 -172.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 70.0 p 47.13 54.69 9.03 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.878 1.671 . . . . 0.0 114.186 173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -93.0 85.81 5.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 173.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.518 ' HB3' HD13 ' A' ' 47' ' ' LEU . 84.6 mm-40 -69.29 129.81 40.83 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.624 ' HB ' HD12 ' A' ' 43' ' ' LEU . 30.9 m -150.75 157.72 43.29 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 124.003 0.921 . . . . 0.0 109.03 -173.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.81 161.95 36.74 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.953 0.901 . . . . 0.0 109.702 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 37' ' ' GLU . 5.2 mpt_? -86.94 149.78 24.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 168.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.432 HM22 ' OG1' ' A' ' 35' ' ' THR . . . . . . . . 0 N--CA 1.474 0.764 0 C-N-CA 122.806 0.442 . . . . 0.0 110.752 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 14.5 p -80.33 61.76 4.23 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.666 0.787 . . . . 0.0 110.476 175.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 7.2 t -70.41 -25.92 63.44 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.727 0.811 . . . . 0.0 111.266 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -115.89 27.68 8.13 Favored Glycine 0 C--N 1.346 1.119 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 172.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.29 143.29 18.05 Favored Glycine 0 C--N 1.349 1.29 0 C-N-CA 123.229 0.443 . . . . 0.0 112.291 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.18 154.53 17.2 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.95 0.9 . . . . 0.0 109.696 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.881 0 C-N-CA 123.818 0.847 . . . . 0.0 108.722 178.486 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 CA-C-O 120.035 -0.314 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -91.97 130.86 37.63 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.318 0.647 . . . . 0.0 111.127 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -77.7 89.72 3.98 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.65 0.78 . . . . 0.0 109.424 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.578 HG12 ' HG2' ' B' ' 8' ' ' ARG . 31.1 m -101.89 137.76 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.583 0.753 . . . . 0.0 109.788 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -134.21 159.94 39.39 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 124.062 0.945 . . . . 0.0 109.29 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.59 144.3 32.49 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.951 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.456 HG21 HD13 ' A' ' 47' ' ' LEU . 22.7 m -91.09 154.81 3.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.099 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.5 tt0 -82.88 -57.89 3.11 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 160.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -163.52 177.65 8.65 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.917 1.287 . . . . 0.0 109.351 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.1 mm -81.2 114.94 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 162.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -54.84 18.3 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.75 0.82 . . . . 0.0 109.453 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -143.59 169.82 17.0 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.8 0.84 . . . . 0.0 111.092 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -149.23 135.41 19.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.53 1.132 . . . . 0.0 108.888 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -160.74 175.51 12.53 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.556 0.743 . . . . 0.0 109.16 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -117.94 114.84 46.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 CA-C-O 121.511 0.672 . . . . 0.0 109.573 170.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -105.9 97.67 7.46 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 124.878 1.271 . . . . 0.0 109.678 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 62.16 41.88 10.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 172.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.13 -15.11 63.67 Favored Glycine 0 N--CA 1.472 1.097 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.301 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm -88.4 109.93 20.41 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.435 0.694 . . . . 0.0 109.2 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.29 106.14 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 77.5 mt-10 -114.09 150.19 34.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.718 -168.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -122.6 116.7 24.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.438 -1.71 . . . . 0.0 108.2 -176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.0 tp -69.22 104.27 2.16 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.431 HG21 ' NE2' ' A' ' 41' ' ' HIS . 14.8 t -94.08 108.68 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -170.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -76.89 120.73 22.43 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.1 m95 -93.24 153.26 18.7 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.12 0.568 . . . . 0.0 110.433 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -70.98 -9.27 57.69 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -163.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -149.47 24.17 1.21 Allowed Glycine 0 N--CA 1.474 1.221 0 CA-C-N 117.937 0.335 . . . . 0.0 112.342 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 51.0 m95 -123.4 136.9 27.65 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 124.131 0.972 . . . . 0.0 108.484 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -59.13 159.76 21.12 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 122.941 2.427 . . . . 0.0 112.959 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -53.39 -30.2 51.78 Favored 'Trans proline' 0 C--N 1.382 2.297 0 C-N-CA 123.393 2.729 . . . . 0.0 114.278 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.1 -15.02 58.76 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -99.85 17.24 21.3 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.598 0.759 . . . . 0.0 111.698 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -81.1 141.19 34.54 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.2 p -110.19 130.13 55.6 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -169.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.58 96.46 1.97 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.838 0.455 . . . . 0.0 109.986 170.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -123.47 131.58 24.29 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.155 0.982 . . . . 0.0 109.92 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.594 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 84.4 Cg_endo -70.59 170.63 17.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.131 2.554 . . . . 0.0 113.672 -175.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -53.39 -17.11 1.67 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.847 1.259 . . . . 0.0 114.316 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.29 -39.24 89.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.933 0.893 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.47 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 9.3 p-80 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.806 0.442 . . . . 0.0 111.996 -177.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.8 mm -67.85 116.01 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 124.324 1.049 . . . . 0.0 110.515 -175.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.2 mt -99.22 8.55 44.7 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.954 0.502 . . . . 0.0 111.348 -176.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -150.08 118.98 3.7 Favored Pre-proline 0 N--CA 1.483 1.199 0 C-N-CA 123.581 0.753 . . . . 0.0 109.714 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.47 -36.8 52.55 Favored 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 122.954 2.436 . . . . 0.0 112.576 -177.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -65.12 -22.33 66.92 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 125.221 1.408 . . . . 0.0 111.469 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.456 HD13 HG21 ' A' ' 7' ' ' VAL . 16.9 tp -59.56 -52.17 66.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.816 0.846 . . . . 0.0 111.375 174.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.88 -42.23 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.569 0.699 . . . . 0.0 111.02 178.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -74.46 -26.81 60.27 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.649 -171.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.93 -29.05 55.47 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.126 0.571 . . . . 0.0 111.11 175.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -59.44 -45.75 90.7 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.529 0.731 . . . . 0.0 109.953 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.87 -16.95 49.02 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.581 178.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 69.06 5.93 5.35 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.177 1.391 . . . . 0.0 113.259 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -80.52 152.83 28.48 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 80.38 -15.69 0.72 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 125.831 1.653 . . . . 0.0 112.161 -174.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 C--O 1.251 1.173 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.382 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -82.36 72.6 9.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 23.6 m -91.91 148.54 22.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.19 0.996 . . . . 0.0 109.095 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -69.48 82.88 0.4 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.736 0.779 . . . . 0.0 110.563 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -108.84 80.81 1.37 Allowed 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.4 p -76.06 148.39 38.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.268 -176.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.47 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.94 132.3 16.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.824 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG2' HG12 ' A' ' 4' ' ' VAL . 23.4 mtm180 -84.44 170.41 13.57 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.207 0.603 . . . . 0.0 111.074 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.47 HM11 ' CE2' ' A' ' 29' ' ' TRP . . . . . . . . 0 N--CA 1.479 1.009 0 C-N-CA 123.719 0.808 . . . . 0.0 108.838 171.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 79.3 p -161.48 -174.38 4.24 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.463 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -150.31 159.48 44.42 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.881 0.873 . . . . 0.0 109.485 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.75 -60.32 0.87 Allowed Glycine 0 C--N 1.343 0.936 0 CA-C-O 120.001 -0.333 . . . . 0.0 112.977 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 58.36 35.38 78.71 Favored Glycine 0 C--N 1.352 1.419 0 O-C-N 123.748 0.323 . . . . 0.0 112.971 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -87.99 135.51 33.38 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.95 0.9 . . . . 0.0 111.083 -172.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.31 0 C-N-CA 123.975 0.91 . . . . 0.0 108.68 172.931 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.528 0 N-CA-C 111.296 -0.721 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -98.27 98.47 9.73 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.161 0.984 . . . . 0.0 109.926 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -82.19 138.66 34.63 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.551 0.74 . . . . 0.0 111.112 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.4 HG12 ' HG2' ' B' ' 8' ' ' ARG . 35.5 m -85.5 138.62 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.688 0.795 . . . . 0.0 110.756 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -131.12 157.61 42.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.764 0.826 . . . . 0.0 109.771 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.17 107.22 10.6 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 123.578 0.751 . . . . 0.0 109.333 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.91 154.2 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.832 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.1 tt0 -93.44 -52.94 4.27 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.409 0.683 . . . . 0.0 109.668 177.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -161.93 168.21 23.3 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.67 1.188 . . . . 0.0 109.839 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.459 HD13 HG22 ' A' ' 24' ' ' VAL . 32.4 mm -77.28 115.07 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 162.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.437 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -69.86 -58.61 3.67 Favored 'General case' 0 CA--C 1.556 1.177 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.082 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.437 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.0 mtpp -139.08 171.48 14.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.978 0.911 . . . . 0.0 110.994 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -154.32 133.05 12.2 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.651 1.18 . . . . 0.0 108.569 -171.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -160.23 179.57 8.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.981 0.913 . . . . 0.0 110.074 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 8.9 p -129.81 138.04 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.461 0.704 . . . . 0.0 109.966 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -138.74 100.68 4.13 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.503 1.121 . . . . 0.0 108.904 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 60.59 36.86 19.71 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.127 0.971 . . . . 0.0 111.43 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.58 -10.77 73.52 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.2 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -99.8 108.84 21.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.218 0.607 . . . . 0.0 110.18 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 59.9 t -76.95 112.31 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.608 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -96.27 139.3 32.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.669 0.788 . . . . 0.0 109.835 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -118.72 110.18 16.96 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.7 tp -69.84 105.37 2.76 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 167.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.584 HG21 ' HE1' ' A' ' 41' ' ' HIS . 76.2 t -101.05 118.88 48.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -77.39 115.66 17.34 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 171.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 11.1 m95 -90.38 144.44 25.81 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 30.5 ttmt -64.23 -53.85 42.75 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -166.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.83 1.46 86.28 Favored Glycine 0 CA--C 1.533 1.172 0 N-CA-C 113.798 0.279 . . . . 0.0 113.798 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.6 m95 -114.81 135.8 22.44 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.741 0.816 . . . . 0.0 109.322 -177.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -64.51 160.7 38.41 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 C-N-CA 122.467 2.111 . . . . 0.0 112.038 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.52 -22.25 21.22 Favored 'Trans proline' 0 C--N 1.384 2.416 0 C-N-CA 123.531 2.821 . . . . 0.0 114.48 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -77.39 -35.78 54.03 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.507 0.323 . . . . 0.0 111.489 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -82.9 0.38 44.58 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.071 0.549 . . . . 0.0 111.242 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.1 m -70.67 140.83 51.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.43 0.692 . . . . 0.0 109.669 171.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -132.06 156.49 46.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.267 0.627 . . . . 0.0 111.811 -167.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -95.41 112.28 24.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.528 1.131 . . . . 0.0 109.351 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.569 ' HG2' ' HA ' ' B' ' 9' ' ' M3L . 18.3 mp0 -116.95 144.39 33.41 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.612 0.765 . . . . 0.0 109.435 172.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.82 160.5 49.42 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 123.081 2.521 . . . . 0.0 112.171 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -50.33 -28.59 8.17 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 125.921 1.688 . . . . 0.0 114.629 -167.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.748 ' HG2' HH22 ' B' ' 8' ' ' ARG . 39.4 tt0 -64.1 -30.11 71.2 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.587 0.755 . . . . 0.0 112.224 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.584 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.1 p80 -64.1 -22.52 66.97 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.48 114.24 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.18 0.592 . . . . 0.0 109.53 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.3 mt -85.04 -63.88 1.25 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -77.75 118.37 71.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.003 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.79 -25.61 39.38 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.501 2.134 . . . . 0.0 111.961 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -70.98 -16.69 62.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.667 0.787 . . . . 0.0 111.03 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' B' ' 5' ' ' GLN . 14.5 tp -60.48 -52.92 63.16 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.964 . . . . 0.0 111.255 172.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.2 t -76.35 -38.65 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.274 0.63 . . . . 0.0 109.764 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtm -67.95 -27.99 67.08 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.229 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.24 -43.85 49.3 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.976 0.353 . . . . 0.0 110.051 175.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -56.19 -54.81 40.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.056 0.542 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -79.21 -7.79 58.52 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.971 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 60.01 32.35 21.04 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.768 1.227 . . . . 0.0 110.783 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -76.92 84.14 3.47 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.045 -175.706 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -85.03 78.02 9.98 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 CA--C 1.551 1.007 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.468 -171.829 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.372 0.13 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -72.15 97.59 1.97 Allowed 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 111.415 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 62.5 m -64.42 -44.21 91.93 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.342 173.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 55.05 78.45 0.18 Allowed 'General case' 0 C--O 1.244 0.776 0 C-N-CA 125.026 1.33 . . . . 0.0 110.982 -172.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.486 ' HB2' HD13 ' A' ' 47' ' ' LEU . 21.7 pt20 -59.36 114.34 2.62 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 113.77 -1.559 . . . . 0.0 109.514 169.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 11.2 m -127.11 141.65 51.71 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.279 0.632 . . . . 0.0 110.37 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.84 148.76 31.23 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.136 0.974 . . . . 0.0 109.819 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.748 HH22 ' HG2' ' A' ' 40' ' ' GLU . 70.3 mtm-85 -86.35 176.08 8.08 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.218 0.607 . . . . 0.0 110.783 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.569 ' HA ' ' HG2' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.477 0.885 0 C-N-CA 122.752 0.421 . . . . 0.0 110.84 169.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 37.2 t -78.55 159.23 28.26 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 12.5 t -141.09 157.14 45.71 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 123.775 0.83 . . . . 0.0 109.269 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.76 -44.35 3.24 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 111.859 -0.497 . . . . 0.0 111.859 -175.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.35 158.25 34.02 Favored Glycine 0 C--N 1.35 1.359 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 -177.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -153.72 158.7 41.39 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.127 0.571 . . . . 0.0 111.375 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.555 1.143 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.735 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.941 0 N-CA-C 112.029 -0.429 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -126.76 44.49 2.88 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.827 0.851 . . . . 0.0 110.458 -172.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.494 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.3 mp0 -73.91 124.24 25.79 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.171 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 m -115.72 125.61 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.948 0.899 . . . . 0.0 110.439 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.494 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 83.4 m-85 -122.36 155.89 35.08 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.011 0.524 . . . . 0.0 110.499 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.45 110.32 3.08 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.072 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.624 HG21 HD13 ' A' ' 47' ' ' LEU . 16.4 m -84.16 154.66 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.54 0.736 . . . . 0.0 110.391 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.2 tt0 -91.23 -65.64 1.0 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 171.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.3 m -163.44 175.51 10.7 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.329 1.452 . . . . 0.0 108.251 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.509 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.7 mm -74.78 119.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 165.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -74.19 -45.04 50.93 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -156.38 159.69 38.98 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.237 0.615 . . . . 0.0 109.928 -175.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -149.91 147.55 28.05 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.328 0.651 . . . . 0.0 109.905 -172.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -168.2 -173.99 2.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.22 1.008 . . . . 0.0 109.323 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -126.56 123.13 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.737 0.815 . . . . 0.0 108.893 173.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -150.07 150.35 31.6 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.93 24.85 13.78 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.625 1.17 . . . . 0.0 111.128 -173.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.71 16.05 67.38 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-N 116.102 -0.499 . . . . 0.0 113.235 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -126.7 145.85 50.43 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.466 1.106 . . . . 0.0 109.219 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.18 112.5 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -96.08 140.67 30.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.406 0.683 . . . . 0.0 109.977 -175.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HB3' HD12 ' A' ' 10' ' ' ILE . 93.3 m-85 -125.97 109.8 12.87 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.993 0.917 . . . . 0.0 109.077 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.7 tp -68.87 89.44 0.4 Allowed 'General case' 0 C--N 1.344 0.355 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.546 HG21 ' NE2' ' A' ' 41' ' ' HIS . 89.9 t -85.93 115.98 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 122.85 0.46 . . . . 0.0 109.886 -174.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -79.23 111.38 15.41 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.3 m95 -83.41 130.01 35.02 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.9 ttpt -62.09 -51.23 68.77 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.08 8.78 59.5 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 123.204 0.315 . . . . 0.0 113.658 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 65.8 m95 -123.42 137.96 29.33 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.084 0.954 . . . . 0.0 109.338 -174.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.506 ' HG2' ' CD1' ' A' ' 33' ' ' TYR . 29.7 Cg_endo -63.87 153.7 74.13 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 122.946 2.431 . . . . 0.0 113.212 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -38.53 -47.95 2.55 Favored 'Trans proline' 0 C--N 1.389 2.707 1 C-N-CA 125.888 4.392 . . . . 0.0 117.293 -171.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -72.36 -17.58 61.82 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -171.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.506 ' CD1' ' HG2' ' A' ' 30' ' ' PRO . 76.8 m-85 -84.6 7.54 19.82 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.246 0.618 . . . . 0.0 111.961 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.6 p -68.49 124.24 23.03 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 167.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 p -112.33 142.15 45.19 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.158 0.583 . . . . 0.0 111.086 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -77.14 81.71 3.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.784 0.834 . . . . 0.0 109.17 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -94.08 127.51 44.69 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.174 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.43 175.84 9.52 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.425 2.083 . . . . 0.0 113.263 -173.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.07 -34.2 9.27 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.794 1.637 . . . . 0.0 113.797 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -58.58 -30.02 66.86 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.737 1.215 . . . . 0.0 112.934 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.568 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.0 p-80 -84.48 -16.76 41.34 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -170.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.4 mm -67.31 123.37 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.065 0.546 . . . . 0.0 109.882 -176.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.554 HD21 ' HG2' ' B' ' 8' ' ' ARG . 30.0 mt -99.22 -44.82 6.11 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.822 0.344 . . . . 0.0 110.469 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 26.3 t70 -110.74 129.27 24.14 Favored Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.67 -176.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.26 -27.03 41.38 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 123.107 2.538 . . . . 0.0 113.571 -175.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.598 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 41.4 mmt180 -70.13 -15.68 63.0 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.947 0.499 . . . . 0.0 111.507 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.624 HD13 HG21 ' A' ' 7' ' ' VAL . 18.9 tp -58.91 -44.43 91.25 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.549 0.74 . . . . 0.0 110.368 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -89.13 -35.9 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.316 0.646 . . . . 0.0 110.664 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.598 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 75.8 mmm -68.76 -33.94 74.74 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.028 0.931 . . . . 0.0 112.243 -175.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.07 -28.42 63.32 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.582 0.353 . . . . 0.0 110.497 175.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -75.24 -45.42 40.26 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.242 1.017 . . . . 0.0 111.65 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -84.44 -55.75 3.98 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.855 0.462 . . . . 0.0 111.059 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -92.34 81.11 4.93 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -69.16 145.43 53.29 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.423 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -73.82 -11.5 60.4 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.146 174.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 124.78 1.232 . . . . 0.0 109.305 168.944 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.789 0 CA-C-O 120.642 0.258 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -77.58 -4.96 48.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.195 0.598 . . . . 0.0 112.525 -177.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.4 t -67.1 89.28 0.18 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 122.518 1.152 . . . . 0.0 109.275 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.488 ' HG3' HG23 ' B' ' 6' ' ' THR . 17.9 tppt? -149.78 126.22 10.86 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.337 -172.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.415 ' HA ' ' HB3' ' A' ' 44' ' ' ASP . 3.3 mp0 -72.18 103.23 3.27 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.488 HG23 ' HG3' ' B' ' 4' ' ' LYS . 5.1 p -122.98 162.91 21.41 Favored 'General case' 0 C--O 1.248 1.021 0 C-N-CA 124.079 0.952 . . . . 0.0 110.22 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.568 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -157.19 126.69 6.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.408 -172.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.554 ' HG2' HD21 ' A' ' 43' ' ' LEU . 14.8 mmt85 -68.51 157.56 35.7 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 172.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.405 ' HE2' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.473 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 109.654 170.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 33.2 t -68.88 87.97 0.37 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.373 1.069 . . . . 0.0 108.748 173.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 10.5 m -77.6 81.47 4.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.065 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.27 -76.58 1.45 Allowed Glycine 0 C--N 1.347 1.181 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.713 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.8 104.0 0.66 Allowed Glycine 0 C--N 1.351 1.383 0 C-N-CA 123.473 0.558 . . . . 0.0 113.281 -177.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.67 -174.91 2.97 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.676 1.19 . . . . 0.0 109.719 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.283 0 C-N-CA 123.099 0.559 . . . . 0.0 110.222 179.189 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -87.02 -14.66 40.96 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 110.845 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -71.84 104.89 3.59 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.309 1.044 . . . . 0.0 111.707 -168.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.78 140.1 18.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.126 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -134.29 141.7 47.04 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 171.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.13 113.19 4.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.294 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.45 HG22 ' O ' ' B' ' 5' ' ' GLN . 15.9 m -90.07 154.55 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.019 0.527 . . . . 0.0 111.132 -173.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -84.18 -68.98 0.67 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 168.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -159.4 -179.6 8.09 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mm -83.0 121.36 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -60.21 2.35 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.252 1.021 . . . . 0.0 108.54 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -137.67 169.82 17.13 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.956 0.902 . . . . 0.0 110.523 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -153.65 128.17 9.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.814 0.846 . . . . 0.0 109.083 -170.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -162.61 -173.74 3.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.222 1.009 . . . . 0.0 110.104 -176.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.38 143.89 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.148 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 4.1 ttm180 -147.98 115.07 6.16 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.108 0.963 . . . . 0.0 108.614 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 55.5 mtpt 63.84 32.43 13.39 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.159 0.984 . . . . 0.0 111.851 172.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.47 -15.15 63.01 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.261 -0.881 . . . . 0.0 113.021 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -96.58 110.68 23.04 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.689 0.796 . . . . 0.0 109.588 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.98 109.49 8.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -97.62 137.97 35.73 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 122.747 0.419 . . . . 0.0 110.32 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -115.51 110.22 18.95 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 167.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.1 tp -67.13 101.79 0.94 Allowed 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.476 HG21 ' HE1' ' A' ' 41' ' ' HIS . 71.9 t -97.42 122.62 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 122.221 0.209 . . . . 0.0 111.092 -172.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -78.57 119.46 21.87 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -89.0 140.55 29.32 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.97 0.908 . . . . 0.0 109.429 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -62.0 -51.46 67.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.063 0.545 . . . . 0.0 112.399 -168.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.43 9.14 78.12 Favored Glycine 0 C--N 1.346 1.084 0 N-CA-C 114.071 0.388 . . . . 0.0 114.071 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.9 m95 -127.84 137.62 31.15 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -175.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -64.2 159.01 45.27 Favored 'Trans proline' 0 C--N 1.377 2.044 0 C-N-CA 122.608 2.205 . . . . 0.0 111.812 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -60.09 -11.73 16.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.61 2.873 . . . . 0.0 115.708 -171.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -80.32 -18.32 49.51 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 118.851 0.75 . . . . 0.0 111.323 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -88.91 2.22 54.13 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.739 0.815 . . . . 0.0 111.407 172.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 t -64.13 123.53 19.3 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.2 p -119.1 156.82 29.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.689 0.796 . . . . 0.0 110.912 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -95.17 116.21 28.43 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.785 0.834 . . . . 0.0 108.833 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -119.5 149.76 48.49 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 123.497 0.719 . . . . 0.0 109.381 171.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.16 149.56 81.89 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 121.943 1.762 . . . . 0.0 110.409 168.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -56.6 -16.38 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.522 1.129 . . . . 0.0 113.991 -168.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.63 -28.44 65.66 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.757 1.223 . . . . 0.0 112.477 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.476 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.2 p80 -72.9 -15.6 61.58 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.504 HG21 HG23 ' A' ' 48' ' ' VAL . 37.4 mm -69.89 120.37 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 123.599 0.759 . . . . 0.0 109.666 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.509 HD21 ' HG3' ' B' ' 8' ' ' ARG . 26.0 mt -86.58 -15.41 39.94 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.616 0.366 . . . . 0.0 111.344 -177.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -147.9 125.86 5.91 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.201 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -55.61 -31.74 80.45 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.785 2.99 . . . . 0.0 113.86 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.452 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.3 mmt180 -65.22 -16.8 63.93 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.413 HD13 HG21 ' A' ' 7' ' ' VAL . 13.3 tp -69.61 -48.42 60.15 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.182 0.593 . . . . 0.0 110.595 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.504 HG23 HG21 ' A' ' 42' ' ' ILE . 26.1 t -69.01 -39.47 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 CA-C-O 121.439 0.638 . . . . 0.0 109.903 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 93.5 mtp -69.81 -32.57 71.09 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 114.328 -1.305 . . . . 0.0 111.236 -176.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -28.62 69.84 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.357 0.663 . . . . 0.0 111.639 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -64.48 -55.31 21.55 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.486 0.714 . . . . 0.0 110.85 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -87.96 -45.79 9.93 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.357 0.663 . . . . 0.0 110.462 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -83.77 66.67 9.18 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.614 ' H ' ' HD3' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -69.57 152.15 45.12 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.528 -174.157 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 64.65 24.86 13.02 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.716 1.207 . . . . 0.0 111.694 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 124.003 0.921 . . . . 0.0 109.514 176.409 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -77.78 95.12 4.61 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 10.0 t -162.04 168.6 22.45 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 124.149 0.98 . . . . 0.0 109.528 -175.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -118.88 72.1 0.87 Allowed 'General case' 0 C--O 1.247 0.935 0 C-N-CA 123.605 0.762 . . . . 0.0 109.499 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.45 ' O ' HG22 ' A' ' 7' ' ' VAL . 5.2 pm0 -65.15 123.05 18.5 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 169.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -136.43 165.74 25.11 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 123.881 0.872 . . . . 0.0 110.796 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.439 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -153.44 140.08 18.89 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.671 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.509 ' HG3' HD21 ' A' ' 43' ' ' LEU . 70.0 mtm180 -79.52 145.28 33.28 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.02 0.528 . . . . 0.0 109.673 174.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.23 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.478 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 36.2 t -74.64 177.67 5.94 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.573 1.149 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 15.1 t -131.95 14.79 4.77 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.86 172.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.79 32.49 61.21 Favored Glycine 0 C--N 1.355 1.633 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.408 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.82 -80.93 1.11 Allowed Glycine 0 C--N 1.343 0.946 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -164.22 125.71 2.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.091 0.557 . . . . 0.0 110.233 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 174.816 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.539 ' HA ' ' O ' ' B' ' 9' ' ' M3L . 5.3 mp0 -84.67 75.35 10.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.259 1.024 . . . . 0.0 109.187 -174.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -112.28 140.59 46.87 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.73 0.812 . . . . 0.0 110.195 -172.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.5 m -82.73 138.07 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 122.989 0.516 . . . . 0.0 110.58 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -135.06 146.1 48.61 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 123.832 0.853 . . . . 0.0 108.947 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.65 120.61 13.76 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.742 0.817 . . . . 0.0 109.55 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 9.5 m -95.78 153.48 3.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 C-N-CA 123.03 0.532 . . . . 0.0 110.183 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 36.0 tt0 -86.57 -65.59 1.0 Allowed 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 170.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -158.79 -179.27 7.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.373 1.069 . . . . 0.0 109.168 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -88.93 121.88 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 163.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -62.4 1.65 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -125.15 171.58 10.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.434 0.694 . . . . 0.0 111.476 -176.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -155.27 144.44 20.94 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 109.68 -173.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -168.56 -175.98 2.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.259 1.024 . . . . 0.0 109.41 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.14 127.9 20.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 52.2 ttt-85 -140.69 125.81 18.49 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HG2' ' HG2' ' A' ' 16' ' ' ARG . 72.7 mmtt 64.44 25.16 13.3 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.48 1.112 . . . . 0.0 111.507 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.65 74.53 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.156 -0.474 . . . . 0.0 113.204 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -89.89 110.6 21.54 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.021 0.928 . . . . 0.0 108.905 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 t -77.88 105.47 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.71 137.3 36.82 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.264 0.626 . . . . 0.0 110.019 -169.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -126.51 112.57 15.72 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.9 tp -69.2 86.91 0.4 Allowed 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.34 112.6 6.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 C-N-CA 123.199 0.6 . . . . 0.0 109.656 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -77.55 110.53 12.43 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 171.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.3 m95 -82.71 153.71 25.19 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 39.6 ttmt -70.8 -60.84 2.02 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.138 0.575 . . . . 0.0 112.33 -167.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.07 6.83 77.84 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 116.252 -0.431 . . . . 0.0 113.13 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.9 m95 -118.06 134.64 23.31 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.223 1.009 . . . . 0.0 109.072 -177.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.83 171.4 12.29 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.795 2.33 . . . . 0.0 111.858 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.5 -14.53 44.89 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 122.78 2.32 . . . . 0.0 113.664 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -83.28 -6.72 59.57 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.303 0.641 . . . . 0.0 112.227 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -114.94 13.22 17.0 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.031 0.932 . . . . 0.0 110.613 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.2 m -82.37 133.42 35.22 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 27.3 p -116.16 143.39 45.56 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.912 0.885 . . . . 0.0 110.494 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -71.09 82.12 0.69 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 170.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -101.33 109.48 58.92 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.551 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.45 162.95 31.59 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.537 2.158 . . . . 0.0 113.336 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -54.05 -26.55 27.2 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.178 1.391 . . . . 0.0 112.165 174.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -56.27 -31.88 64.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.275 1.43 . . . . 0.0 111.628 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -113.36 -10.93 13.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.887 0.875 . . . . 0.0 112.097 -174.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 44.3 mm -65.61 141.63 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 170.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.9 pp -113.38 -12.25 13.03 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.812 1.187 . . . . 0.0 112.214 178.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -101.26 117.02 63.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 173.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.12 -38.0 93.31 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.438 2.092 . . . . 0.0 110.323 166.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.67 ' HG3' HG22 ' B' ' 3' ' ' THR . 21.2 mmm180 -62.3 -23.25 66.63 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.194 0.998 . . . . 0.0 113.292 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 19.5 tp -66.52 -52.52 44.93 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 118.26 0.482 . . . . 0.0 110.674 178.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 90.7 t -72.94 -37.61 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.034 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.408 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 61.4 mtt -60.5 -38.83 85.59 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.705 0.802 . . . . 0.0 111.268 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.06 -33.96 76.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.577 0.751 . . . . 0.0 110.581 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -69.06 -41.27 77.82 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.344 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.0 mm-40 -64.86 -39.6 93.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.74 0.416 . . . . 0.0 110.845 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -92.68 9.87 33.03 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.601 0.76 . . . . 0.0 111.735 -177.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.537 ' HG2' ' HG3' ' A' ' 56' ' ' GLU . 18.8 ttpp -56.65 119.57 6.35 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.154 0.981 . . . . 0.0 111.706 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -75.2 89.57 2.53 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.222 1.009 . . . . 0.0 111.025 -177.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.537 ' HG3' ' HG2' ' A' ' 54' ' ' LYS . 58.8 mt-10 . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 59.04 27.83 16.89 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.419 1.088 . . . . 0.0 110.891 -174.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.67 HG22 ' HG3' ' A' ' 46' ' ' ARG . 31.4 p -106.98 79.29 1.31 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.856 1.262 . . . . 0.0 109.366 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.16 -32.33 30.05 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.777 0.831 . . . . 0.0 110.488 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 61.49 69.55 0.65 Allowed 'General case' 0 CA--C 1.551 1.018 0 O-C-N 124.702 1.251 . . . . 0.0 109.01 -174.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.589 ' HB ' HD11 ' A' ' 43' ' ' LEU . 27.2 m -150.72 145.15 25.61 Favored 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 123.99 0.916 . . . . 0.0 111.278 -169.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -131.36 149.66 52.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.082 0.953 . . . . 0.0 109.615 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.46 ' HG3' HD23 ' A' ' 43' ' ' LEU . 78.9 mtm180 -93.71 126.52 38.93 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.075 0.95 . . . . 0.0 108.921 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.539 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--O 1.222 -0.39 0 O-C-N 123.395 0.434 . . . . 0.0 110.07 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.8 t -66.44 -28.1 68.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.814 0.446 . . . . 0.0 110.269 170.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.405 HG23 ' HB2' ' B' ' 9' ' ' M3L . 29.9 p 52.47 46.22 27.1 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.151 1.38 . . . . 0.0 111.751 -179.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.78 91.35 0.26 Allowed Glycine 0 C--N 1.348 1.229 0 CA-C-N 114.858 -1.064 . . . . 0.0 112.394 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.26 -42.68 99.23 Favored Glycine 0 C--N 1.354 1.56 0 O-C-N 123.757 0.328 . . . . 0.0 112.814 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -86.04 103.27 14.57 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 172.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.952 0 C-N-CA 123.62 0.768 . . . . 0.0 109.092 179.627 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -66.57 90.66 0.17 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.156 0.583 . . . . 0.0 111.051 -176.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -78.78 84.43 4.85 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.739 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.53 143.25 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.842 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.467 ' CD1' ' HE2' ' B' ' 9' ' ' M3L . 26.0 m-85 -139.93 150.59 44.73 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.063 0.945 . . . . 0.0 109.702 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.91 131.12 45.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.925 176.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.5 m -116.46 154.27 18.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.129 0.571 . . . . 0.0 111.383 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 26.3 tt0 -85.14 -58.79 2.54 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.441 1.096 . . . . 0.0 108.503 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.8 m -174.95 -178.65 1.27 Allowed 'General case' 0 C--O 1.243 0.751 0 C-N-CA 126.525 1.93 . . . . 0.0 108.025 178.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.517 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 45.0 mm -78.18 124.5 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -61.14 1.9 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.64 0.776 . . . . 0.0 109.123 176.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.429 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 67.4 mttm -133.99 156.64 47.82 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.856 0.863 . . . . 0.0 110.148 178.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -145.68 141.72 28.35 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.425 0.69 . . . . 0.0 109.466 -176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -165.21 -173.17 2.77 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.398 1.079 . . . . 0.0 109.357 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -135.39 119.33 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.408 0.623 . . . . 0.0 110.359 175.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -102.21 97.62 7.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.187 0.995 . . . . 0.0 108.731 173.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp 56.58 52.75 9.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.357 1.063 . . . . 0.0 113.096 168.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 -3.19 85.85 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.731 -0.668 . . . . 0.0 113.561 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -111.89 111.76 22.94 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 36.9 t -77.77 112.94 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -96.8 138.06 34.93 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.13 0.972 . . . . 0.0 109.876 -171.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.5 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.0 m-85 -127.74 110.14 12.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.162 0.985 . . . . 0.0 109.246 -178.169 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.429 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.5 tp -69.68 101.69 1.72 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.935 -1.505 . . . . 0.0 106.935 165.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 41' ' ' HIS . 25.6 t -93.21 117.72 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 122.495 0.318 . . . . 0.0 110.383 -171.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -80.13 110.9 15.97 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 56.9 m95 -85.55 77.67 9.82 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.131 0.491 . . . . 0.0 109.895 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 85.2 tttt 52.56 -91.15 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.907 1.683 . . . . 0.0 113.022 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -121.61 14.17 9.27 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 122.877 0.275 . . . . 0.0 113.037 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 25.4 m95 -70.84 129.17 90.01 Favored Pre-proline 0 N--CA 1.473 0.698 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 171.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.42 146.4 62.76 Favored 'Trans proline' 0 C--N 1.379 2.15 0 C-N-CA 122.866 2.377 . . . . 0.0 112.068 -175.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -44.74 -29.08 3.25 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 124.623 3.549 . . . . 0.0 116.865 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -74.37 -7.46 52.95 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -104.98 0.98 28.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.998 0.919 . . . . 0.0 111.745 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.6 p -71.94 123.29 22.4 Favored 'General case' 0 C--N 1.351 0.666 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 171.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.0 p -114.42 139.3 49.61 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 0.0 111.934 -169.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -77.49 86.3 3.85 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.328 1.051 . . . . 0.0 110.06 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -101.52 137.78 19.7 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.012 0.925 . . . . 0.0 109.916 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.11 161.41 26.4 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 122.208 1.938 . . . . 0.0 112.634 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -38.37 -33.08 0.09 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 127.291 2.236 . . . . 0.0 116.196 -171.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.78 -30.03 70.14 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.05 0.94 . . . . 0.0 112.635 -172.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 24' ' ' VAL . 6.5 p-80 -71.77 -12.54 61.35 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.8 mm -71.54 128.95 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.086 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.577 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.6 pp -108.52 -4.49 17.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 119.818 1.19 . . . . 0.0 112.853 176.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.9 p-10 -139.58 153.99 70.92 Favored Pre-proline 0 N--CA 1.481 1.081 0 C-N-CA 122.482 0.313 . . . . 0.0 111.484 -171.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -67.66 -40.15 10.58 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.226 1.951 . . . . 0.0 112.793 176.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -61.25 -28.22 69.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.853 0.861 . . . . 0.0 113.116 -165.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.43 -52.46 32.47 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.451 0.7 . . . . 0.0 112.496 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.11 -36.15 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-O 121.43 0.633 . . . . 0.0 110.391 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mtp -74.53 -28.34 60.92 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.319 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 54' ' ' LYS . . . -64.48 -37.81 88.84 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.378 0.671 . . . . 0.0 110.995 177.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.9 t80 -54.52 -51.79 64.04 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.348 1.059 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -65.59 -43.63 89.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.929 -174.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -105.22 52.66 0.73 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.481 -177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.6 OUTLIER -120.81 115.16 22.73 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.827 0.851 . . . . 0.0 110.645 175.685 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.94 79.1 9.33 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 169.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ALA . . . . . 0.683 ' HB1' ' HB2' ' B' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -87.33 -41.8 13.36 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.642 0.777 . . . . 0.0 111.066 -175.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 21.6 p -93.09 -31.78 14.7 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.043 0.937 . . . . 0.0 111.589 -179.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.683 ' HB2' ' HB1' ' B' ' 1' ' ' ALA . 74.2 mmtt -72.46 104.31 3.76 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -73.27 101.9 3.52 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 43' ' ' LEU . 28.4 m -149.33 153.2 37.1 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.288 1.042 . . . . 0.0 110.805 -167.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -142.96 150.05 39.18 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.554 -178.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.409 ' CZ ' ' HB3' ' A' ' 43' ' ' LEU . 2.2 mpt_? -86.54 157.54 19.73 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.467 ' HE2' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 170.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 16.8 p -54.14 101.9 0.05 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.626 0.77 . . . . 0.0 111.28 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.8 t -113.19 143.41 44.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.445 1.098 . . . . 0.0 111.262 -170.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.06 146.21 18.59 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.602 171.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 168.63 -175.37 43.22 Favored Glycine 0 C--N 1.343 0.945 0 N-CA-C 112.259 -0.336 . . . . 0.0 112.259 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 ttmp? -155.25 127.0 7.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.089 0.555 . . . . 0.0 110.54 -177.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.251 0 C-N-CA 124.912 1.285 . . . . 0.0 108.646 169.537 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.963 0 CA-C-O 119.762 -0.465 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -125.69 146.23 49.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.645 0.778 . . . . 0.0 109.67 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -99.78 82.3 2.58 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.407 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.7 m -90.59 143.57 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.64 0.776 . . . . 0.0 110.503 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -139.61 138.18 35.96 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.643 0.777 . . . . 0.0 110.589 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.87 115.21 20.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 164.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.0 m -105.59 158.04 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.334 0.654 . . . . 0.0 111.576 -165.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.88 -56.14 8.86 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.773 0.67 . . . . 0.0 111.21 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -162.02 177.5 9.7 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.942 0.897 . . . . 0.0 110.225 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -83.83 119.61 33.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 157.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.497 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.7 tmt_? -71.42 -62.94 1.23 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.497 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.4 mttt -128.09 160.16 32.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.68 0.792 . . . . 0.0 110.61 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -146.34 140.23 26.25 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.815 1.246 . . . . 0.0 107.788 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -163.89 -175.57 4.14 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.127 0.571 . . . . 0.0 110.03 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.7 p -139.26 124.02 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.434 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 79.0 ttt180 -123.14 106.04 10.43 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.215 1.406 . . . . 0.0 108.569 -173.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 16' ' ' ARG . 37.3 mtmt 65.95 25.49 11.07 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.758 1.223 . . . . 0.0 111.702 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.43 -13.94 66.43 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.603 -0.271 . . . . 0.0 113.0 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -84.76 110.96 19.18 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.242 0.617 . . . . 0.0 110.275 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.525 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 41.1 t -73.2 111.57 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -107.58 144.43 34.62 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.435 0.694 . . . . 0.0 110.864 -171.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -130.2 113.92 15.05 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.042 0.937 . . . . 0.0 110.255 -175.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.2 tp -74.56 93.83 2.56 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 166.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 59.6 t -87.36 116.12 29.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 C-N-CA 122.69 0.396 . . . . 0.0 110.406 -173.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -74.92 113.68 12.5 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.156 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.9 m95 -84.54 132.97 34.46 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.011 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -81.97 110.62 17.39 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 123.475 0.485 . . . . 0.0 109.886 -172.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 113.16 -16.96 22.29 Favored Glycine 0 N--CA 1.473 1.108 0 O-C-N 123.724 0.64 . . . . 0.0 111.681 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 20.6 m95 -107.83 130.54 22.67 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 123.963 0.905 . . . . 0.0 108.901 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 23.8 Cg_endo -59.96 154.61 49.43 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.444 2.096 . . . . 0.0 112.599 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -51.22 -17.8 4.31 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 124.605 3.536 . . . . 0.0 116.166 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -79.96 -35.43 37.65 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.678 0.391 . . . . 0.0 111.138 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.446 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 41.9 m-85 -77.88 -11.36 59.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.468 0.707 . . . . 0.0 111.064 173.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.2 t -61.55 132.29 52.88 Favored 'General case' 0 C--N 1.358 0.972 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.1 p -127.72 164.14 22.78 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.075 0.55 . . . . 0.0 111.572 -170.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -100.16 116.59 32.54 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.39 1.076 . . . . 0.0 109.826 -172.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.41 153.37 72.29 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 168.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.59 -177.51 3.41 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.355 2.037 . . . . 0.0 114.214 -174.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.525 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 9.8 pt-20 -52.02 -31.43 29.78 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.267 1.827 . . . . 0.0 112.687 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.65 -45.99 92.02 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.721 1.208 . . . . 0.0 112.214 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 1.1 p-80 -75.52 -13.7 60.37 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -170.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.8 mm -66.87 104.84 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 175.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.569 HD12 ' HB ' ' B' ' 6' ' ' THR . 20.3 mt -90.39 -51.9 5.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.98 125.46 83.82 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.034 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.44 -37.52 13.14 Favored 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 122.901 2.401 . . . . 0.0 112.313 177.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -63.03 -21.76 66.38 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.764 0.826 . . . . 0.0 111.727 -177.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.1 -50.89 71.89 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.97 0.908 . . . . 0.0 111.618 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 46.8 t -80.24 -43.4 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.967 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.7 mtt -59.68 -45.38 92.26 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.301 1.04 . . . . 0.0 112.412 -175.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -27.27 63.33 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.218 0.607 . . . . 0.0 111.143 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.21 -37.54 78.12 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.616 0.366 . . . . 0.0 110.938 172.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.0 mm-40 -60.42 -60.35 3.94 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.082 0.239 . . . . 0.0 111.265 -175.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 60.38 7.16 1.22 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 124.777 1.231 . . . . 0.0 113.636 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HG2' ' HB3' ' A' ' 52' ' ' GLU . 21.5 pttp -75.57 149.15 38.37 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 123.129 0.572 . . . . 0.0 111.127 -174.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -73.71 91.52 1.91 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.099 175.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.21 1.004 . . . . 0.0 110.865 -179.12 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 32.4 mmt180 -73.0 -46.23 53.41 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.378 0.671 . . . . 0.0 109.55 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 54.2 p -83.92 77.85 9.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.049 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -80.06 79.45 6.61 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.12 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -105.22 95.67 5.99 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.312 1.045 . . . . 0.0 108.869 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.569 ' HB ' HD12 ' A' ' 43' ' ' LEU . 10.8 p -78.99 119.91 22.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.691 -173.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.71 123.6 18.83 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.099 1.36 . . . . 0.0 108.523 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 41' ' ' HIS . 17.8 mtm-85 -93.55 119.95 33.22 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 119.1 -0.476 . . . . 0.0 109.934 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.406 ' HG3' ' CH2' ' A' ' 26' ' ' TRP . . . . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 121.281 0.563 . . . . 0.0 110.88 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.2 t -173.82 -168.78 0.44 Allowed 'General case' 0 C--O 1.245 0.823 0 CA-C-N 114.115 -1.402 . . . . 0.0 108.226 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.6 p -63.49 -36.37 83.53 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.793 0.806 . . . . 0.0 108.886 160.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.44 131.34 1.22 Allowed Glycine 0 C--N 1.342 0.9 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.539 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.97 -35.81 90.04 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -130.43 166.56 20.22 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.633 1.173 . . . . 0.0 109.112 175.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 C-N-CA 123.501 0.721 . . . . 0.0 109.377 179.266 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.196 0 N-CA-C 112.282 -0.327 . . . . 0.0 112.282 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.42 0.77 4.08 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.492 0.717 . . . . 0.0 110.927 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -78.17 82.56 4.48 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.513 0.725 . . . . 0.0 110.721 -169.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.93 127.34 38.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-O 121.041 0.448 . . . . 0.0 111.086 -177.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.26 162.98 20.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.838 0.855 . . . . 0.0 109.173 174.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.54 107.42 5.05 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.281 0.633 . . . . 0.0 110.491 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 9.6 m -75.93 154.09 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.382 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.52 -66.03 0.93 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 163.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.4 m -164.64 -162.34 0.64 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.156 1.782 . . . . 0.0 107.421 174.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -85.38 137.22 21.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 164.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.567 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.8 tmt_? -88.9 -54.3 4.2 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -137.17 163.94 29.67 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.503 0.721 . . . . 0.0 110.618 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -151.49 143.54 23.92 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.144 0.977 . . . . 0.0 108.483 -173.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -164.42 168.0 18.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.683 0.793 . . . . 0.0 110.179 -176.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 20' ' ' VAL . 21.8 t -116.0 125.29 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -123.54 94.9 4.38 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.295 1.038 . . . . 0.0 108.701 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.58 39.15 27.9 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.322 1.049 . . . . 0.0 111.353 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.93 -18.27 57.02 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.371 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -90.9 108.08 19.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.979 0.512 . . . . 0.0 109.688 -177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 15' ' ' VAL . 42.6 t -80.66 109.41 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -176.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 55.8 mt-10 -97.14 155.42 16.83 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.603 0.716 . . . . 0.0 110.864 -176.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.473 ' HB3' HD12 ' A' ' 10' ' ' ILE . 75.2 m-85 -134.65 109.81 8.88 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.102 177.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.15 87.73 0.11 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 63.1 t -74.24 118.75 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.567 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 22.6 tptm -80.19 124.84 29.15 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 36.9 m95 -103.89 134.89 46.43 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.09 -38.79 66.27 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -165.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.36 14.68 60.43 Favored Glycine 0 N--CA 1.474 1.172 0 CA-C-N 116.365 -0.38 . . . . 0.0 113.535 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 69.2 m95 -135.47 135.67 22.7 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 123.658 0.783 . . . . 0.0 110.003 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.99 164.75 21.05 Favored 'Trans proline' 0 CA--C 1.569 2.229 0 C-N-CA 122.971 2.447 . . . . 0.0 112.402 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.91 -13.47 27.32 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 123.793 2.996 . . . . 0.0 114.754 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.8 -23.62 63.36 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.696 0.399 . . . . 0.0 111.866 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -103.58 3.08 34.21 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.727 0.811 . . . . 0.0 112.294 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.4 p -71.21 129.62 39.37 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 169.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 p -118.75 128.27 54.33 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.094 0.558 . . . . 0.0 112.228 -165.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -71.18 101.52 2.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.517 0.727 . . . . 0.0 109.324 173.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -133.31 134.91 24.55 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.502 0.721 . . . . 0.0 109.059 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 68.7 Cg_endo -68.91 167.39 23.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.839 2.359 . . . . 0.0 113.831 -173.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.08 -21.85 0.8 Allowed 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 125.329 1.451 . . . . 0.0 114.59 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -54.73 -44.72 73.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.591 1.156 . . . . 0.0 111.53 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -83.11 -5.64 59.19 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.224 -172.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.543 HG21 HG23 ' A' ' 48' ' ' VAL . 28.5 mm -80.28 121.19 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.625 HD11 ' HG3' ' B' ' 8' ' ' ARG . 5.5 mp -88.09 -47.98 8.08 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.044 0.538 . . . . 0.0 109.606 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -100.51 130.83 24.82 Favored Pre-proline 0 CA--C 1.549 0.928 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.581 -169.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.33 -35.29 24.45 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 122.699 2.266 . . . . 0.0 113.183 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.452 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 56.5 mmm-85 -69.42 -16.15 63.44 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.179 0.592 . . . . 0.0 111.351 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.53 -47.05 80.26 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.238 0.615 . . . . 0.0 110.461 173.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 42' ' ' ILE . 67.5 t -73.58 -44.31 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.583 0.753 . . . . 0.0 110.577 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -67.1 -55.46 14.17 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.008 -171.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.26 -28.36 67.99 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.496 0.718 . . . . 0.0 112.558 -174.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -55.3 -49.92 70.9 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.915 0.886 . . . . 0.0 111.06 171.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -80.09 -31.29 39.27 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.748 0.819 . . . . 0.0 111.605 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 49' ' ' MET . 8.9 pt-20 -124.13 90.67 3.3 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.916 . . . . 0.0 109.037 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -73.89 164.8 26.16 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 122.321 1.058 . . . . 0.0 113.41 -174.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.79 167.99 10.45 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-N 113.209 -1.814 . . . . 0.0 107.556 165.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 . . . . . 0 N--CA 1.486 1.367 0 C-N-CA 124.888 1.275 . . . . 0.0 110.992 171.843 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 121.125 0.488 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -149.67 143.18 25.33 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.779 0.832 . . . . 0.0 109.412 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.5 m -65.97 115.18 5.77 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.452 0.701 . . . . 0.0 110.435 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -135.51 -155.05 0.61 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.674 1.19 . . . . 0.0 109.586 -176.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.415 ' H ' ' NE2' ' B' ' 5' ' ' GLN . 3.1 mp0 -62.39 107.11 0.85 Allowed 'General case' 0 C--N 1.353 0.742 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 161.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.1 m -140.51 155.17 46.73 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 122.927 0.491 . . . . 0.0 110.122 -171.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.73 133.78 22.7 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.324 0.649 . . . . 0.0 111.365 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.625 ' HG3' HD11 ' A' ' 43' ' ' LEU . 94.7 mtt180 -79.38 118.42 21.27 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.844 0.858 . . . . 0.0 110.125 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.454 0 CA-C-N 118.884 0.765 . . . . 0.0 110.561 174.728 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 40.1 t -60.92 139.34 58.03 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 124.607 1.192 . . . . 0.0 109.694 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 22.3 m -61.1 -30.67 70.49 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.015 0.526 . . . . 0.0 110.482 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.46 32.12 65.09 Favored Glycine 0 C--N 1.352 1.454 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.113 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.31 76.66 1.45 Allowed Glycine 0 C--N 1.351 1.367 0 O-C-N 123.842 0.378 . . . . 0.0 112.169 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -168.69 146.8 4.03 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.435 1.094 . . . . 0.0 109.329 -178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.203 0 C-N-CA 123.577 0.751 . . . . 0.0 110.545 175.155 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 111.894 -0.483 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HB3' ' HG3' ' B' ' 8' ' ' ARG . 2.7 mp0 -91.5 125.14 36.14 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.698 0.799 . . . . 0.0 109.313 -177.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -78.47 82.06 4.77 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.448 0.699 . . . . 0.0 109.696 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.463 HG11 HH11 ' B' ' 8' ' ' ARG . 35.2 m -97.06 127.58 49.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.963 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -130.15 148.53 52.0 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 124.088 0.955 . . . . 0.0 108.509 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.85 117.72 9.35 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.022 0.529 . . . . 0.0 109.627 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.447 HG12 ' CE3' ' A' ' 26' ' ' TRP . 11.2 m -99.64 150.79 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 123.171 0.588 . . . . 0.0 110.267 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.575 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 40.0 tt0 -73.62 -72.38 0.27 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -162.07 -176.42 5.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.141 1.377 . . . . 0.0 108.114 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.7 mm -71.3 124.49 27.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.492 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -76.97 -57.21 3.98 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.2 mttm -134.55 160.29 38.51 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.063 0.945 . . . . 0.0 110.421 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -145.61 134.49 22.47 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.91 0.884 . . . . 0.0 109.103 -166.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -167.24 176.58 6.66 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.213 0.605 . . . . 0.0 110.602 -178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -128.47 117.15 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -112.11 101.68 9.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.766 0.826 . . . . 0.0 109.299 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.5 tptp 52.99 53.12 12.54 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.61 1.164 . . . . 0.0 112.229 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.67 -17.06 58.68 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-N 115.324 -0.853 . . . . 0.0 114.066 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -91.82 118.75 30.99 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 174.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 98.3 t -83.49 102.49 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -105.93 138.59 41.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.979 0.512 . . . . 0.0 110.514 -167.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.479 ' HB3' HD12 ' A' ' 10' ' ' ILE . 22.2 m-85 -126.14 113.22 16.76 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.725 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.6 tp -64.62 100.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.975 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 164.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.48 HG21 ' CE1' ' A' ' 41' ' ' HIS . 95.3 t -100.69 129.22 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.27 109.89 19.82 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.125 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.447 ' CE3' HG12 ' A' ' 7' ' ' VAL . 27.1 m95 -83.64 106.79 15.64 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.575 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 63.4 pttt -69.26 -22.43 63.84 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -168.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.78 -36.89 92.83 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.561 0.538 . . . . 0.0 112.389 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -101.65 164.53 15.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.454 1.102 . . . . 0.0 109.48 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.69 152.64 64.68 Favored 'Trans proline' 0 CA--C 1.564 2.006 0 C-N-CA 121.612 1.541 . . . . 0.0 111.351 173.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -59.17 -8.82 7.01 Favored 'Trans proline' 0 C--N 1.388 2.639 0 C-N-CA 124.089 3.193 . . . . 0.0 115.775 -173.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -70.2 -12.72 61.79 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.05 0.386 . . . . 0.0 111.579 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -105.46 18.22 22.59 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.096 0.959 . . . . 0.0 111.286 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -68.76 116.98 9.88 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -109.81 140.48 43.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.293 0.637 . . . . 0.0 111.114 -174.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -75.46 87.33 2.61 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -102.59 127.94 29.2 Favored Pre-proline 0 CA--C 1.551 1.017 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.255 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 57.3 Cg_endo -66.66 159.31 51.68 Favored 'Trans proline' 0 C--N 1.383 2.343 0 C-N-CA 123.235 2.623 . . . . 0.0 112.545 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -58.95 -11.95 3.97 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -167.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.18 -33.57 69.39 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.307 1.043 . . . . 0.0 110.696 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.557 ' ND1' ' HB1' ' B' ' 7' ' ' ALA . 0.3 OUTLIER -79.76 -13.51 59.39 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -174.348 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mm -72.46 122.1 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.914 0.886 . . . . 0.0 110.515 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.7 mt -106.1 -0.92 24.34 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.773 0.429 . . . . 0.0 111.643 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -145.43 128.0 8.1 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 109.427 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -62.66 -43.72 20.18 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.627 2.218 . . . . 0.0 112.527 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.532 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 58.7 mtt180 -70.41 -15.48 62.84 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.833 0.853 . . . . 0.0 111.648 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.0 tp -53.63 -46.03 70.35 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.326 0.65 . . . . 0.0 110.213 168.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.82 -39.44 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 124.044 0.938 . . . . 0.0 111.317 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.532 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 20.2 mmt -71.68 -45.06 63.08 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.684 0.794 . . . . 0.0 111.874 -171.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.92 -26.91 65.33 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.506 0.722 . . . . 0.0 111.867 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -54.56 -44.2 72.7 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.123 0.569 . . . . 0.0 110.883 174.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -99.3 -13.66 19.56 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.841 0.456 . . . . 0.0 111.671 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 61.01 63.19 1.3 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.292 1.037 . . . . 0.0 111.868 -178.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.34 -2.47 12.63 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.22 0.608 . . . . 0.0 112.403 177.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -80.37 85.19 5.88 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 . . . . . 0 C--O 1.251 1.149 0 CA-C-N 114.885 -1.052 . . . . 0.0 108.545 -178.271 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -98.49 26.17 5.75 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.011 0.924 . . . . 0.0 110.026 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.1 p -62.4 93.57 0.05 Allowed 'General case' 0 C--N 1.356 0.888 0 C-N-CA 124.027 0.931 . . . . 0.0 110.277 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -139.6 77.02 1.59 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.805 -174.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.436 ' O ' HG22 ' A' ' 7' ' ' VAL . 19.4 mp0 -63.12 117.24 6.24 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 171.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 m -121.61 150.09 42.21 Favored 'General case' 0 C--O 1.249 1.051 0 C-N-CA 123.832 0.853 . . . . 0.0 109.425 -174.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.557 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -156.34 147.0 21.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.279 0.632 . . . . 0.0 111.136 -175.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 2' ' ' GLU . 2.2 mpt_? -83.84 159.69 21.33 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.478 0.711 . . . . 0.0 110.127 174.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 121.008 0.432 . . . . 0.0 110.758 168.362 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 15.2 m -58.52 100.95 0.07 Allowed 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.799 173.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.1 m -62.73 95.02 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.006 0.523 . . . . 0.0 110.469 -177.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.64 -12.25 59.67 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 115.412 -0.813 . . . . 0.0 113.808 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 75.03 68.48 1.54 Allowed Glycine 0 C--N 1.349 1.29 0 N-CA-C 112.03 -0.428 . . . . 0.0 112.03 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -92.06 -30.37 16.06 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.629 0.772 . . . . 0.0 110.988 -177.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.188 0 C-N-CA 123.455 0.702 . . . . 0.0 109.421 178.229 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.908 0 CA-C-O 120.198 -0.223 . . . . 0.0 112.888 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -97.39 153.93 17.78 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.486 0.714 . . . . 0.0 111.277 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.518 ' HB2' ' HB3' ' B' ' 9' ' ' M3L . 45.4 mt-30 -108.88 94.0 4.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.113 0.965 . . . . 0.0 110.433 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.18 119.53 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -118.66 157.31 27.68 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.675 0.79 . . . . 0.0 109.625 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.51 123.86 21.99 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.054 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.598 HG21 HD13 ' A' ' 47' ' ' LEU . 12.4 m -97.1 153.28 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 123.696 0.798 . . . . 0.0 111.097 -173.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -81.95 -78.5 0.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 163.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.6 m -161.22 -173.75 4.0 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.997 1.319 . . . . 0.0 107.759 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.766 HD12 ' HB3' ' A' ' 22' ' ' TYR . 43.0 mm -81.09 115.72 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 169.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -57.68 6.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.123 0.969 . . . . 0.0 109.382 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.5 mttm -136.44 162.45 33.02 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.154 0.982 . . . . 0.0 110.008 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -146.58 141.09 26.6 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.706 0.803 . . . . 0.0 108.89 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -162.89 -176.57 4.99 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.687 1.195 . . . . 0.0 108.966 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 23.9 t -128.21 144.95 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -147.16 116.95 7.15 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt 65.73 28.74 10.95 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.563 1.145 . . . . 0.0 110.747 175.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.1 -12.97 58.76 Favored Glycine 0 C--N 1.352 1.455 0 CA-C-N 115.485 -0.779 . . . . 0.0 113.011 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -95.79 112.37 24.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.284 0.634 . . . . 0.0 109.639 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.0 t -70.41 119.95 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.451 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -94.0 142.35 27.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.514 0.725 . . . . 0.0 109.658 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.766 ' HB3' HD12 ' A' ' 10' ' ' ILE . 97.7 m-85 -130.4 108.08 9.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.284 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.431 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 44.1 tp -65.96 84.51 0.08 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.03 109.54 2.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -77.62 124.97 28.62 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 172.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m95 -97.84 136.53 38.03 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 28' ' ' GLY . 0.1 OUTLIER -65.25 -31.12 72.11 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -168.032 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.51 ' N ' ' HD3' ' A' ' 27' ' ' LYS . . . -97.78 2.56 60.33 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.946 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 33' ' ' TYR . 60.4 m95 -124.58 133.36 24.69 Favored Pre-proline 0 N--CA 1.471 0.61 0 C-N-CA 123.576 0.75 . . . . 0.0 109.647 -172.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.12 165.18 12.94 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.028 2.485 . . . . 0.0 112.277 174.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -57.53 -23.36 56.01 Favored 'Trans proline' 0 C--N 1.39 2.745 0 C-N-CA 123.254 2.636 . . . . 0.0 114.154 -176.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -13.33 61.35 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.13 0.572 . . . . 0.0 112.495 177.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 81.9 m-85 -113.86 1.39 14.76 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.585 0.754 . . . . 0.0 112.306 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.9 p -69.14 130.29 42.27 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 171.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.2 p -117.78 138.57 51.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.084 0.554 . . . . 0.0 111.404 -169.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -72.87 84.66 1.23 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.638 0.775 . . . . 0.0 109.087 176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -96.95 116.33 66.03 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.445 0.698 . . . . 0.0 109.131 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.72 176.2 4.55 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.464 2.109 . . . . 0.0 113.882 -175.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -50.41 -36.31 32.36 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.96 1.704 . . . . 0.0 113.212 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -60.84 -34.88 75.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.404 1.082 . . . . 0.0 112.382 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -83.37 -23.64 32.35 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.354 0.662 . . . . 0.0 112.258 -173.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.586 HG21 HG23 ' A' ' 48' ' ' VAL . 27.0 mm -71.93 108.45 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HB ' ' B' ' 6' ' ' THR . 4.6 pp -99.46 -24.5 14.76 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 117.667 0.212 . . . . 0.0 111.505 -173.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -104.11 120.54 50.64 Favored Pre-proline 0 N--CA 1.475 0.801 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -64.83 -20.12 64.53 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.3 2.0 . . . . 0.0 111.583 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -61.19 -20.51 62.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.835 1.254 . . . . 0.0 112.222 177.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.598 HD13 HG21 ' A' ' 7' ' ' VAL . 16.7 tp -71.72 -47.49 53.54 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.056 0.542 . . . . 0.0 111.164 178.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.586 HG23 HG21 ' A' ' 42' ' ' ILE . 78.8 t -77.67 -37.72 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.346 0.658 . . . . 0.0 110.682 179.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.6 mmt -67.08 -41.06 87.01 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.14 -178.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.91 70.31 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.278 0.561 . . . . 0.0 111.493 178.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -71.8 -53.24 13.97 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.231 1.013 . . . . 0.0 110.937 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.11 -56.14 3.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.795 0.438 . . . . 0.0 111.236 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 64.85 16.58 10.56 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.608 1.163 . . . . 0.0 111.933 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.51 131.62 40.2 Favored 'General case' 0 C--N 1.353 0.718 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -95.66 15.79 19.03 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.228 1.011 . . . . 0.0 110.325 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 . . . . . 0 C--O 1.249 1.057 0 C-N-CA 124.41 1.084 . . . . 0.0 109.248 174.62 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 59.92 17.54 6.67 Favored 'General case' 0 N--CA 1.496 1.874 0 C-N-CA 125.223 1.409 . . . . 0.0 112.342 -173.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 39.8 p -99.46 131.16 45.65 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.35 1.06 . . . . 0.0 108.246 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.79 -176.17 5.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.87 0.468 . . . . 0.0 110.899 -171.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -147.58 104.19 3.6 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -176.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.592 ' HB ' HD11 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -147.85 152.6 37.9 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.434 0.635 . . . . 0.0 111.692 -172.902 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.88 160.62 37.11 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.392 1.077 . . . . 0.0 109.494 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 -97.88 151.04 20.65 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.246 1.019 . . . . 0.0 109.198 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.518 ' HB3' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 121.249 0.547 . . . . 0.0 110.97 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 4.8 p -68.71 82.39 0.28 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.639 175.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.2 m -75.58 99.91 4.42 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.802 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 167.88 -142.64 7.63 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.849 -176.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -178.41 154.22 14.24 Favored Glycine 0 C--N 1.35 1.321 0 CA-C-N 117.341 0.571 . . . . 0.0 113.662 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -78.28 144.16 36.39 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 109.989 176.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.09 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 174.549 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.147 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.75 66.46 7.32 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.59 0.756 . . . . 0.0 111.12 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -92.58 107.64 19.37 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.827 175.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -96.79 140.88 16.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -130.26 142.03 50.58 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.264 0.626 . . . . 0.0 109.461 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 126.91 30.68 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.729 169.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.99 154.66 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.022 0.439 . . . . 0.0 111.565 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 42.9 tt0 -78.33 -63.57 1.37 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.946 172.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.6 m -165.56 173.39 10.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.681 1.192 . . . . 0.0 110.073 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.457 HD12 ' HB3' ' A' ' 22' ' ' TYR . 41.3 mm -85.11 126.59 40.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 162.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -52.79 6.26 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.99 170.04 16.7 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.829 0.852 . . . . 0.0 110.17 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -156.61 145.63 20.29 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.131 0.573 . . . . 0.0 110.094 -173.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -159.93 169.88 22.55 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.896 0.878 . . . . 0.0 109.208 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.41 115.91 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 166.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -137.0 126.45 25.04 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -174.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 65.46 24.95 11.91 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.016 0.913 . . . . 0.0 110.374 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.89 -9.05 47.31 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.282 -0.872 . . . . 0.0 113.18 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -93.92 111.43 23.14 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 123.988 0.915 . . . . 0.0 108.918 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.403 ' HB ' ' HG3' ' A' ' 39' ' ' GLU . 23.6 t -77.17 106.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -98.4 138.6 35.4 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 123.96 0.904 . . . . 0.0 110.288 -173.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 59.0 m-85 -122.61 117.25 25.39 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 tp -71.07 81.77 0.69 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.552 HG21 ' NE2' ' A' ' 41' ' ' HIS . 85.6 t -75.88 110.35 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.009 -169.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -75.39 107.44 7.51 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 52.7 m95 -75.78 147.83 38.93 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.093 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.6 OUTLIER -64.46 -54.49 31.79 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.164 0.586 . . . . 0.0 112.146 -169.192 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.81 13.19 64.0 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 116.207 -0.451 . . . . 0.0 113.796 -175.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 70.5 m95 -117.78 141.43 29.08 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 123.526 0.73 . . . . 0.0 109.772 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 41.3 Cg_endo -64.59 160.83 38.06 Favored 'Trans proline' 0 CA--C 1.563 1.932 0 C-N-CA 122.904 2.403 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.16 -20.37 46.13 Favored 'Trans proline' 0 C--N 1.389 2.659 0 C-N-CA 123.604 2.869 . . . . 0.0 115.184 -177.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -74.22 -19.81 60.39 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.412 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 39.3 m-85 -96.22 5.72 50.4 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.793 0.837 . . . . 0.0 111.897 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.9 p -68.36 117.85 10.68 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.7 p -106.06 144.29 32.99 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.503 0.721 . . . . 0.0 110.797 -173.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.04 80.03 1.71 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.051 0.929 . . . . 0.0 109.889 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -83.82 120.79 75.59 Favored Pre-proline 0 C--O 1.242 0.682 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.953 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.35 155.63 69.04 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 121.933 1.755 . . . . 0.0 111.428 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.403 ' HG3' ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -49.89 -19.89 0.78 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.686 1.595 . . . . 0.0 114.849 -177.332 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -55.35 -32.72 62.78 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.461 1.104 . . . . 0.0 112.854 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.604 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.8 p-80 -82.07 -12.22 58.37 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.89 120.63 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.935 0.894 . . . . 0.0 110.335 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.465 HD12 HG22 ' B' ' 6' ' ' THR . 38.0 mt -110.02 2.23 19.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.756 0.423 . . . . 0.0 110.985 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -150.89 127.19 5.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.328 0.651 . . . . 0.0 110.622 -174.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.32 -37.33 40.74 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.943 2.428 . . . . 0.0 112.199 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -64.81 -18.49 65.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.452 0.701 . . . . 0.0 111.478 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.87 -52.59 48.98 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.224 0.61 . . . . 0.0 111.314 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.05 -37.64 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-O 121.567 0.699 . . . . 0.0 110.075 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.6 mmt -70.98 -29.24 65.15 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.847 -178.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -30.56 70.76 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.007 0.432 . . . . 0.0 110.692 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -76.07 -56.29 4.79 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.543 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.45 -54.47 5.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.079 0.551 . . . . 0.0 110.934 -171.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -88.96 58.16 4.45 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -81.87 124.42 29.69 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.948 -170.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -79.9 91.75 5.43 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.317 0.647 . . . . 0.0 109.711 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.798 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 51.6 22.54 1.61 Allowed 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 126.333 1.853 . . . . 0.0 113.596 177.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 37.1 p -75.56 76.03 2.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.713 0.805 . . . . 0.0 112.455 -169.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -86.85 -29.94 21.84 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.862 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.43 97.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.265 169.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.465 HG22 HD12 ' A' ' 43' ' ' LEU . 13.0 m -117.87 150.99 38.27 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.913 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.604 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -151.56 129.53 11.77 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.976 -175.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 -68.78 171.25 8.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.838 0.855 . . . . 0.0 110.792 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.689 0 CA-C-O 120.711 0.291 . . . . 0.0 111.394 167.073 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 43.4 m -60.76 89.95 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.058 0.943 . . . . 0.0 111.102 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 17.9 m -147.48 141.14 25.58 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 -2.55 57.37 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -171.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 85.63 -118.97 4.95 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 111.948 -0.461 . . . . 0.0 111.948 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm 61.21 16.74 7.51 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.947 1.299 . . . . 0.0 112.607 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 C-N-CA 124.267 1.027 . . . . 0.0 109.244 -176.648 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 65.94 98.92 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.01 1.324 . . . . 0.0 110.575 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.44 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 1.8 mp0 -105.41 105.66 15.8 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.736 0.815 . . . . 0.0 109.714 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -105.35 130.37 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.44 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 37.3 m-85 -130.18 164.05 25.32 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.545 0.738 . . . . 0.0 109.747 179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.35 115.05 5.87 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.601 HG21 HD13 ' A' ' 47' ' ' LEU . 14.2 m -79.94 156.06 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 123.085 0.554 . . . . 0.0 110.242 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.586 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 37.1 tt0 -85.75 -67.93 0.77 Allowed 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 161.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 m -164.99 -167.79 1.29 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.157 1.383 . . . . 0.0 108.142 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.477 HD12 ' HB3' ' A' ' 22' ' ' TYR . 46.4 mm -91.93 133.2 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 163.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -88.22 -54.8 4.03 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.444 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 97.7 mttt -136.83 176.87 8.32 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.718 0.807 . . . . 0.0 110.583 -178.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -153.62 144.7 22.88 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -160.18 -175.04 4.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.923 0.889 . . . . 0.0 109.272 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.9 p -142.81 132.5 22.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 173.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -134.27 105.4 6.61 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.134 0.974 . . . . 0.0 109.101 -172.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.6 39.52 29.79 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.79 1.236 . . . . 0.0 111.566 -178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.92 -18.27 56.26 Favored Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.811 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -87.13 110.57 20.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 117.077 0.438 . . . . 0.0 110.764 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -75.06 110.15 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.603 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 34.8 mt-10 -101.11 146.69 27.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.472 0.709 . . . . 0.0 110.538 -173.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.9 m-85 -127.16 119.25 26.02 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.444 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 35.3 tp -70.46 82.84 0.58 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.97 107.19 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -176.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -77.58 118.94 20.47 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 40.1 m95 -92.61 149.43 21.35 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.586 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 3.5 tppp? -61.13 -51.61 68.35 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.189 0.996 . . . . 0.0 112.991 -167.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.93 6.53 76.63 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.61 -0.328 . . . . 0.0 113.576 -177.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 36.1 m95 -121.46 132.52 24.2 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.806 0.843 . . . . 0.0 109.632 -169.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 47.3 Cg_endo -66.03 165.96 22.32 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.974 2.449 . . . . 0.0 112.78 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.0 0.44 2.57 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 123.46 2.773 . . . . 0.0 115.207 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -91.88 -31.61 15.62 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 118.233 0.469 . . . . 0.0 111.077 168.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.448 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 49.4 m-85 -86.08 -1.75 57.68 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.461 0.705 . . . . 0.0 111.343 175.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.1 p -70.9 141.09 51.18 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 168.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.68 141.54 51.58 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.818 0.447 . . . . 0.0 111.935 -170.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -76.35 85.29 3.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.202 1.001 . . . . 0.0 110.282 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -95.22 114.63 64.2 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.513 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 71.9 Cg_exo -53.63 172.35 0.25 Allowed 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 123.653 2.902 . . . . 0.0 114.845 176.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.26 66.29 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.857 -176.348 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -70.72 -29.27 65.5 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.897 0.479 . . . . 0.0 111.352 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -77.22 -33.03 56.25 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.231 0.612 . . . . 0.0 110.624 177.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 36.0 mm -71.79 116.9 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.1 15.39 23.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.565 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -134.37 127.97 19.07 Favored Pre-proline 0 N--CA 1.476 0.829 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.24 -56.53 1.54 Allowed 'Trans proline' 0 C--N 1.378 2.094 0 C-N-CA 122.594 2.196 . . . . 0.0 112.183 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.514 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 84.6 mtt85 -69.54 -15.27 63.2 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.75 0.82 . . . . 0.0 112.993 -170.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 23.8 tp -56.94 -44.36 82.45 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-O 121.121 0.486 . . . . 0.0 110.126 169.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.563 HG23 HG21 ' A' ' 42' ' ' ILE . 53.8 t -84.25 -48.85 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.469 1.107 . . . . 0.0 111.122 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.514 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.7 mmt -62.41 -37.97 87.86 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.214 -170.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.94 -45.43 85.81 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.818 0.447 . . . . 0.0 111.137 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -54.41 -50.73 66.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.088 0.955 . . . . 0.0 111.445 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -84.45 -6.14 59.35 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 63.23 27.45 15.55 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.141 0.976 . . . . 0.0 110.881 -173.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -78.93 84.62 4.95 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.171 0.988 . . . . 0.0 110.454 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -92.56 -17.06 24.92 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.76 0.824 . . . . 0.0 110.029 169.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 124.518 1.127 . . . . 0.0 110.834 175.9 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 37.98 39.34 0.24 Allowed 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 125.792 1.637 . . . . 0.0 113.273 -174.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.3 m -88.48 41.28 1.01 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.975 0.91 . . . . 0.0 110.029 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -73.94 -16.78 61.08 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.385 0.674 . . . . 0.0 109.383 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -57.98 104.5 0.2 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 165.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.9 p -141.85 159.61 41.87 Favored 'General case' 0 C--O 1.256 1.445 0 C-N-CA 123.902 0.881 . . . . 0.0 110.258 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.56 141.79 30.83 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.432 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -88.93 135.83 33.33 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.399 0.68 . . . . 0.0 109.406 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.79 0 O-C-N 123.085 0.241 . . . . 0.0 110.522 176.861 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 48.0 t -50.14 109.79 0.33 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.863 1.265 . . . . 0.0 111.508 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.2 p -75.3 -3.32 32.67 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.861 -176.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.94 103.74 0.9 Allowed Glycine 0 C--N 1.347 1.17 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 170.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.83 -48.0 51.67 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 -177.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.96 173.35 16.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.368 0.667 . . . . 0.0 110.621 176.307 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 124.858 1.263 . . . . 0.0 111.104 178.435 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -66.77 -38.15 86.02 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.525 0.73 . . . . 0.0 111.379 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -117.42 105.59 12.3 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.543 0.737 . . . . 0.0 110.176 -174.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.468 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.4 m -131.1 98.41 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.754 1.222 . . . . 0.0 109.426 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.16 156.29 22.54 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.133 0.573 . . . . 0.0 111.372 -172.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.25 139.67 38.89 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.018 169.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.4 HG12 ' CE3' ' A' ' 26' ' ' TRP . 10.1 m -120.23 157.11 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.68 0.792 . . . . 0.0 110.646 -171.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 5.9 tp10 -61.5 -65.21 0.73 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 164.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.01 -179.52 4.69 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.479 1.112 . . . . 0.0 109.412 -179.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.8 mm -75.19 106.33 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 161.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.546 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -63.07 -54.01 44.65 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.366 0.667 . . . . 0.0 110.191 -178.104 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -138.62 172.96 12.11 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.408 0.683 . . . . 0.0 110.389 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -153.39 127.17 8.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.852 0.861 . . . . 0.0 108.779 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.87 178.43 9.16 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.357 0.663 . . . . 0.0 110.373 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.62 116.05 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.759 0.824 . . . . 0.0 108.962 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -131.53 121.65 24.81 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.6 tptt 65.62 26.41 11.57 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.518 1.127 . . . . 0.0 110.672 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.66 -13.39 58.7 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.821 -176.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -86.95 110.55 20.1 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.261 0.625 . . . . 0.0 109.483 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.9 t -77.79 107.24 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -104.05 136.14 44.25 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.901 0.481 . . . . 0.0 110.275 -172.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -113.92 121.06 42.79 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.546 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.9 tp -71.36 113.93 8.91 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG21 ' CE1' ' A' ' 41' ' ' HIS . 13.1 t -100.5 108.14 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -170.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -77.3 110.39 11.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.238 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 34' ' ' SER . 38.8 m95 -87.18 133.31 33.66 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 8' ' ' GLU . 2.9 tppp? -80.34 -50.08 10.65 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.346 0.658 . . . . 0.0 111.543 -172.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.75 -4.19 87.84 Favored Glycine 0 CA--C 1.54 1.65 0 N-CA-C 114.03 0.372 . . . . 0.0 114.03 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.5 m95 -120.28 149.43 49.53 Favored Pre-proline 0 N--CA 1.48 1.036 0 C-N-CA 124.247 1.019 . . . . 0.0 109.956 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.06 150.97 87.25 Favored 'Trans proline' 0 C--N 1.382 2.298 0 C-N-CA 122.685 2.257 . . . . 0.0 112.601 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -54.75 -30.39 66.87 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 124.507 3.472 . . . . 0.0 116.013 -167.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -73.02 -17.02 61.48 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -78.97 -1.36 34.98 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.909 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 57.0 m -67.12 116.51 8.0 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 174.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 p -97.97 141.24 31.18 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.138 0.975 . . . . 0.0 111.139 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -78.96 105.6 10.4 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 167.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.427 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 13.1 mm-40 -121.34 126.99 26.33 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.236 1.014 . . . . 0.0 109.402 -173.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -57.26 142.43 94.71 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 123.565 2.843 . . . . 0.0 111.87 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -54.4 -24.36 19.45 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -164.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.88 -24.81 67.99 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 124.265 1.026 . . . . 0.0 112.003 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.44 ' CE1' HG21 ' A' ' 24' ' ' VAL . 2.7 p80 -70.43 -19.49 62.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.458 0.703 . . . . 0.0 112.457 -174.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.605 HG23 HD23 ' A' ' 47' ' ' LEU . 36.8 mm -71.44 134.08 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.334 0.654 . . . . 0.0 109.432 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.496 HD12 ' HB ' ' B' ' 6' ' ' THR . 31.7 mt -100.15 5.12 44.81 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.154 0.582 . . . . 0.0 111.534 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 42' ' ' ILE . 32.5 t70 -151.13 125.34 4.48 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 122.757 0.423 . . . . 0.0 111.379 -174.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -64.55 -37.05 39.77 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.526 2.151 . . . . 0.0 112.699 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.448 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 88.8 mtt-85 -68.27 -15.12 63.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.487 0.715 . . . . 0.0 111.989 -175.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.605 HD23 HG23 ' A' ' 42' ' ' ILE . 12.0 tp -69.06 -52.51 27.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.384 0.674 . . . . 0.0 110.598 173.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.18 -33.43 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 121.594 0.711 . . . . 0.0 109.609 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.448 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 97.7 mmm -73.74 -29.38 62.2 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.971 176.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 54' ' ' LYS . . . -67.3 -29.68 69.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.563 0.345 . . . . 0.0 110.347 174.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -71.7 -57.72 4.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.39 0.676 . . . . 0.0 110.709 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -79.23 -24.47 43.02 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.31 -168.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -107.1 16.34 24.25 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.248 0.619 . . . . 0.0 111.519 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 34.7 ttmt -73.12 168.49 18.98 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 66.08 18.73 11.07 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 124.464 1.106 . . . . 0.0 110.62 -173.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 C--O 1.246 0.893 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.324 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' B' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.18 -51.4 58.16 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.919 0.888 . . . . 0.0 110.91 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 10.2 m -109.52 67.99 0.66 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.759 0.79 . . . . 0.0 109.092 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.533 ' HB2' ' HB1' ' B' ' 1' ' ' ALA . 20.8 tptm -94.29 69.68 3.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.7 mm100 -106.01 109.66 21.67 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.14 -175.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.496 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.4 p -74.66 128.74 36.29 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.475 0.71 . . . . 0.0 111.119 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.45 134.85 36.29 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.468 ' HG2' HG12 ' A' ' 4' ' ' VAL . 97.0 mtt180 -74.69 171.62 13.58 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.822 0.82 . . . . 0.0 112.503 -177.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.486 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.545 166.55 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 76.7 p -168.54 160.74 11.18 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.784 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 14.9 t -106.32 4.09 28.26 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.699 1.2 . . . . 0.0 109.987 167.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 174.95 168.26 35.34 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -133.23 21.2 4.13 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-N 118.29 1.045 . . . . 0.0 114.204 -174.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -121.36 115.43 22.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.922 0.489 . . . . 0.0 110.676 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.453 0.701 . . . . 0.0 110.171 178.35 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.878 0 N-CA-C 112.288 -0.325 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.415 ' HA ' ' HA ' ' B' ' 11' ' ' THR . 12.2 pt-20 -70.77 -179.61 2.27 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.547 0.739 . . . . 0.0 111.454 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -154.9 118.48 4.54 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.7 m -111.49 148.2 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.043 0.937 . . . . 0.0 110.58 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -146.78 164.07 33.97 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.816 0.847 . . . . 0.0 111.258 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.68 126.01 28.59 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.071 173.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 47' ' ' LEU . 35.8 m -104.95 151.45 7.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 124.051 0.94 . . . . 0.0 111.025 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -86.17 -70.52 0.59 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 168.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.8 m -162.4 -177.63 5.78 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 125.176 1.39 . . . . 0.0 108.544 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.6 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.1 mm -76.5 119.84 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 168.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.11 -50.89 36.14 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -142.67 158.15 43.95 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.78 0.832 . . . . 0.0 110.565 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -142.76 125.46 15.93 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.303 0.641 . . . . 0.0 109.824 -169.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -154.52 175.22 13.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.568 0.747 . . . . 0.0 109.546 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 11.5 p -118.31 142.94 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 171.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.455 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -150.57 120.87 7.31 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.805 0.842 . . . . 0.0 108.983 -176.264 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.455 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 27.7 mtpp 60.98 29.45 19.02 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.396 1.078 . . . . 0.0 111.747 178.342 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.3 -13.44 65.12 Favored Glycine 0 C--N 1.353 1.51 0 CA-C-N 116.091 -0.504 . . . . 0.0 113.457 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -103.72 117.6 34.77 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.729 0.811 . . . . 0.0 110.092 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 53.0 t -69.33 110.14 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.62 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 69.5 mt-10 -98.7 144.51 27.89 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.203 1.001 . . . . 0.0 110.477 -176.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.6 ' HB3' HD12 ' A' ' 10' ' ' ILE . 74.5 m-85 -126.78 116.95 21.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.726 -1.124 . . . . 0.0 108.573 -174.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.58 102.2 0.88 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 166.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -87.65 117.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -81.65 113.38 19.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 172.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -84.26 125.28 32.09 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -61.19 -43.1 99.42 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.482 0.713 . . . . 0.0 112.048 -169.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.78 4.55 83.54 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-O 119.609 -0.551 . . . . 0.0 114.177 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 39.0 m95 -120.99 143.12 36.11 Favored Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 123.499 0.72 . . . . 0.0 110.177 -178.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.37 152.13 82.71 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.93 2.42 . . . . 0.0 111.914 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.75 -34.1 5.46 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 124.893 3.729 . . . . 0.0 117.108 -171.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -69.98 -17.37 63.29 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.812 0.733 . . . . 0.0 112.816 -173.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -88.54 4.97 44.89 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.854 0.462 . . . . 0.0 111.713 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -64.15 124.25 21.18 Favored 'General case' 0 C--N 1.351 0.655 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.0 p -112.13 127.3 55.89 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.291 0.636 . . . . 0.0 112.009 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -75.88 78.91 2.78 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.789 0.835 . . . . 0.0 109.919 175.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.472 ' HG3' ' HA ' ' B' ' 9' ' ' M3L . 13.8 mm-40 -104.47 143.69 27.2 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.62 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 92.4 Cg_endo -77.97 176.72 9.66 Favored 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 122.264 1.976 . . . . 0.0 113.474 -172.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -48.21 -22.45 0.66 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.887 1.675 . . . . 0.0 113.816 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -56.61 -31.01 63.88 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.69 1.596 . . . . 0.0 113.289 175.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HD2' ' HB1' ' B' ' 7' ' ' ALA . 9.4 p-80 -87.13 -8.83 56.59 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.225 0.61 . . . . 0.0 112.359 -168.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 26.4 mm -80.18 122.69 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.124 0.569 . . . . 0.0 110.956 -171.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.578 HD11 ' HG3' ' B' ' 8' ' ' ARG . 6.8 mp -96.29 -15.97 21.63 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 177.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -150.94 130.46 6.6 Favored Pre-proline 0 N--CA 1.473 0.677 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -176.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.63 -25.35 54.56 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 123.162 2.575 . . . . 0.0 113.692 -173.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.12 -19.53 61.61 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.004 0.522 . . . . 0.0 111.546 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.478 HD13 HG21 ' A' ' 7' ' ' VAL . 10.7 tp -60.29 -47.21 87.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.881 0.472 . . . . 0.0 110.994 176.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.37 -46.65 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.512 0.725 . . . . 0.0 110.448 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -62.46 -54.26 42.71 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.762 -175.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.23 70.04 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.13 0.423 . . . . 0.0 111.692 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.17 -56.92 15.59 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.898 0.479 . . . . 0.0 109.955 172.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -72.85 -18.89 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.178 0.591 . . . . 0.0 111.044 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 63.49 24.57 14.13 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.327 1.451 . . . . 0.0 109.527 -165.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -70.26 108.26 4.1 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 125.682 1.593 . . . . 0.0 109.771 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -136.87 76.44 1.59 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 C--O 1.249 1.048 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 175.969 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -129.49 148.33 51.38 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.393 1.077 . . . . 0.0 109.542 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 37.8 m -103.71 115.83 31.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.682 0.793 . . . . 0.0 109.298 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -66.9 135.88 54.52 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 174.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 -65.2 -40.48 94.25 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.005 0.522 . . . . 0.0 110.632 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 10.9 m 70.05 138.59 0.04 OUTLIER 'General case' 0 C--O 1.253 1.287 0 C-N-CA 124.604 1.162 . . . . 0.0 112.231 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.635 ' HB1' ' HD2' ' A' ' 41' ' ' HIS . . . -146.37 135.39 22.57 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.334 -175.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG3' HD11 ' A' ' 43' ' ' LEU . 44.7 mtp180 -74.41 163.51 27.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 166.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.472 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 168.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 76.3 p -158.88 159.77 35.39 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.19 178.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 55.2 m -78.73 100.6 7.15 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.64 93.62 0.18 Allowed Glycine 0 C--N 1.343 0.941 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.675 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -155.63 -70.18 0.01 OUTLIER Glycine 0 C--N 1.339 0.746 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -111.05 139.07 46.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.928 0.891 . . . . 0.0 109.458 176.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.829 0 C-N-CA 123.822 0.849 . . . . 0.0 109.917 -178.519 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.6 m -124.77 142.51 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.651 0.78 . . . . 0.0 110.614 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -135.41 163.21 30.55 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.285 1.034 . . . . 0.0 109.173 176.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.03 105.72 3.43 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.4 0.68 . . . . 0.0 109.376 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.498 HG12 ' CZ3' ' A' ' 26' ' ' TRP . 1.6 m -87.56 154.13 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.906 -176.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -82.08 -79.99 0.17 Allowed 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.0 m -160.21 -174.04 4.33 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.517 1.127 . . . . 0.0 108.804 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.558 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.4 mm -80.88 134.72 26.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 172.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.73 4.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.902 0.881 . . . . 0.0 109.571 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -133.43 153.72 51.37 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.979 0.911 . . . . 0.0 109.306 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -135.73 135.32 39.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.7 ptm85 -162.47 173.36 14.15 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.606 0.762 . . . . 0.0 110.106 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 20' ' ' VAL . 14.4 t -119.34 119.9 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 175.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -118.93 110.75 17.52 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.985 0.914 . . . . 0.0 110.059 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp 60.55 31.5 20.26 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 124.287 1.035 . . . . 0.0 111.832 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.48 10.04 62.42 Favored Glycine 0 C--N 1.352 1.467 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.377 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -124.64 111.82 16.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.956 0.903 . . . . 0.0 109.98 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 15' ' ' VAL . 38.4 t -70.62 108.15 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.666 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 18.9 pt-20 -107.57 151.26 25.85 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.796 0.808 . . . . 0.0 110.696 -176.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.558 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -130.71 125.88 35.06 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.33 -173.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.8 tp -73.89 83.2 1.69 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.1 t -68.59 111.08 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -76.74 117.56 18.48 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.498 ' CZ3' HG12 ' A' ' 7' ' ' VAL . 26.6 m95 -90.46 121.1 32.12 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 176.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -70.43 -37.75 74.45 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -161.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.04 -10.99 84.21 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 116.523 -0.308 . . . . 0.0 113.268 177.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.409 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.8 m95 -108.43 148.99 38.75 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.618 1.167 . . . . 0.0 109.165 -177.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 56.9 Cg_endo -66.9 159.65 50.68 Favored 'Trans proline' 0 CA--C 1.559 1.742 0 C-N-CA 122.092 1.861 . . . . 0.0 111.141 177.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.93 -16.22 48.15 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.966 2.444 . . . . 0.0 113.449 -176.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -31.22 65.61 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.169 0.588 . . . . 0.0 111.694 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.41 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 29.2 m-85 -88.65 9.74 23.12 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.526 0.73 . . . . 0.0 111.802 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.7 m -75.33 132.39 40.94 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.7 p -121.4 168.25 11.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.621 0.768 . . . . 0.0 111.059 -172.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -97.39 95.18 7.5 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.253 0.621 . . . . 0.0 110.997 -175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -96.96 122.88 55.31 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 123.645 0.778 . . . . 0.0 109.327 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 59.4 Cg_endo -69.03 171.24 14.0 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.085 1.857 . . . . 0.0 112.291 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -27.17 44.66 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.143 0.977 . . . . 0.0 111.774 174.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.87 -34.9 70.25 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.47 1.508 . . . . 0.0 111.293 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -98.64 -19.76 17.36 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.187 0.995 . . . . 0.0 111.511 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.672 HG23 HD23 ' A' ' 47' ' ' LEU . 51.2 mm -71.35 114.42 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 123.024 0.53 . . . . 0.0 109.974 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.424 HD21 ' HD3' ' B' ' 8' ' ' ARG . 31.1 mt -83.65 -50.49 8.14 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.552 0.691 . . . . 0.0 110.14 -177.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -93.39 133.14 28.83 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.525 -166.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.26 -38.62 8.63 Favored 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.625 2.217 . . . . 0.0 112.201 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.503 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 47.6 mtm180 -69.82 -17.18 63.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.316 1.046 . . . . 0.0 111.119 -176.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.672 HD23 HG23 ' A' ' 42' ' ' ILE . 19.6 tp -59.21 -48.73 80.53 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 123.901 0.88 . . . . 0.0 111.142 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 80.7 t -84.46 -38.73 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.509 0.724 . . . . 0.0 110.675 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.503 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 57.7 mtt -64.94 -32.12 73.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.348 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.94 82.31 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.88 0.472 . . . . 0.0 109.862 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -58.84 -38.19 78.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.495 1.118 . . . . 0.0 111.718 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -176.194 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.475 ' O ' HG22 ' A' ' 7' ' ' VAL . 4.8 pm0 . . . . . 0 CA--C 1.549 0.933 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 23.8 m -146.99 153.25 39.84 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.105 0.478 . . . . 0.0 111.903 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.07 148.6 42.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.863 1.265 . . . . 0.0 108.858 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.424 ' HD3' HD21 ' A' ' 43' ' ' LEU . 2.8 mpt_? . . . . . 0 N--CA 1.484 1.27 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 170.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.6 mp0 . . . . . 0 CA--C 1.543 0.689 0 CA-C-O 120.763 0.316 . . . . 0.0 111.544 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.15 126.84 52.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 123.775 0.83 . . . . 0.0 109.362 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 38.7 m-85 -131.0 152.74 49.99 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.297 0.639 . . . . 0.0 110.583 -177.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.15 107.72 1.65 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.311 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 HD13 ' A' ' 47' ' ' LEU . 20.3 m -90.85 155.88 3.05 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.314 1.046 . . . . 0.0 110.742 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -83.22 -74.01 0.38 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 161.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.6 m -161.4 -177.57 6.07 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.325 1.05 . . . . 0.0 109.628 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.6 mm -76.33 114.49 16.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 172.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.0 -51.48 38.85 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 123.343 0.657 . . . . 0.0 109.369 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -139.28 155.82 47.48 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.792 0.837 . . . . 0.0 110.355 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -146.12 134.33 21.69 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.093 0.957 . . . . 0.0 109.071 -175.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.439 HH21 ' HB2' ' A' ' 16' ' ' ARG . 7.2 ptm180 -163.21 -174.55 3.87 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.708 1.203 . . . . 0.0 109.465 -173.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -136.66 139.73 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.541 0.736 . . . . 0.0 109.18 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' HH21 ' A' ' 14' ' ' ARG . 22.3 tpt180 -141.72 132.24 25.34 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt 59.49 26.12 15.02 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.599 1.16 . . . . 0.0 112.102 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.05 23.71 73.71 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.414 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -125.68 120.87 31.87 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.641 0.776 . . . . 0.0 109.288 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 28.1 t -73.88 112.96 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.293 0.637 . . . . 0.0 110.348 -174.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -96.86 147.87 23.51 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.493 0.717 . . . . 0.0 110.604 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HB2' ' HE1' ' A' ' 41' ' ' HIS . 90.9 m-85 -132.4 112.35 12.09 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.989 0.916 . . . . 0.0 109.735 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.98 101.0 3.1 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 164.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 88.3 t -93.36 123.61 45.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-O 121.054 0.454 . . . . 0.0 110.321 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -83.98 107.76 16.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.821 172.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 9.1 m95 -83.19 119.05 24.06 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 174.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -69.17 -28.33 66.32 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.269 0.486 . . . . 0.0 111.816 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.39 -23.18 77.66 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.595 -0.275 . . . . 0.0 113.283 175.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 15.0 m95 -107.97 139.37 20.6 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.211 1.004 . . . . 0.0 109.54 -174.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -62.31 156.36 51.57 Favored 'Trans proline' 0 CA--C 1.563 1.964 0 C-N-CA 122.469 2.113 . . . . 0.0 111.86 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.79 -26.48 17.83 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.92 3.08 . . . . 0.0 115.427 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -67.44 -14.29 62.8 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -111.27 18.55 19.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.984 0.914 . . . . 0.0 111.692 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 p -68.69 123.18 20.2 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.0 p -121.28 167.15 13.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.272 0.629 . . . . 0.0 111.588 -172.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -111.16 121.73 46.06 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.204 1.002 . . . . 0.0 109.394 -173.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -129.54 146.44 61.08 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -75.76 174.79 12.22 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.127 1.885 . . . . 0.0 112.701 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 10.8 pt-20 -49.58 -28.28 5.49 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 126.308 1.843 . . . . 0.0 114.613 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.76 -33.7 61.59 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.881 1.272 . . . . 0.0 112.44 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 3.4 p-80 -81.67 -18.83 43.17 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -168.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.7 mm -72.87 113.57 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.95 0.5 . . . . 0.0 109.681 -176.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -88.38 -33.56 17.88 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.98 0.419 . . . . 0.0 110.634 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.455 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 13.6 t70 -119.69 130.64 24.74 Favored Pre-proline 0 N--CA 1.48 1.043 0 C-N-CA 123.822 0.849 . . . . 0.0 110.709 -174.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.95 -36.08 40.48 Favored 'Trans proline' 0 C--N 1.381 2.271 0 C-N-CA 123.066 2.511 . . . . 0.0 113.008 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.457 ' HB2' HE21 ' B' ' 5' ' ' GLN . 95.0 mtt180 -65.37 -23.55 67.01 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.06 0.544 . . . . 0.0 111.05 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.402 HD13 HG21 ' A' ' 7' ' ' VAL . 34.6 tp -56.7 -52.37 65.21 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.652 0.781 . . . . 0.0 111.202 173.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.7 t -71.83 -51.86 29.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.846 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 23.1 mmt -62.09 -28.46 69.63 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.409 -1.269 . . . . 0.0 112.667 -172.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.87 -44.79 92.01 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 121.289 0.566 . . . . 0.0 111.002 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -72.11 -36.85 69.55 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.324 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 . . . . . 0 N--CA 1.475 0.801 0 C-N-CA 122.441 0.296 . . . . 0.0 111.185 -177.985 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.457 HE21 ' HB2' ' A' ' 46' ' ' ARG . 26.6 mp0 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -65.47 145.04 56.62 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 123.695 0.798 . . . . 0.0 111.59 -172.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -137.72 116.69 12.43 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.143 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 41.6 mtm180 . . . . . 0 N--CA 1.473 0.678 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.493 175.272 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 CA--C 1.55 0.961 0 CA-C-O 120.437 0.16 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' B' ' 8' ' ' ARG . 33.4 m -132.07 142.42 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 123.683 0.793 . . . . 0.0 109.821 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -135.53 160.29 38.93 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.044 0.938 . . . . 0.0 110.218 -177.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.73 114.81 4.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.528 0.731 . . . . 0.0 109.927 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.6 m -80.02 153.0 4.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.187 0.518 . . . . 0.0 110.698 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 37.3 tt0 -94.19 -62.33 1.36 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.58 -172.79 2.0 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.528 1.531 . . . . 0.0 108.559 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 mm -91.92 139.45 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 164.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -50.28 4.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.457 0.703 . . . . 0.0 109.916 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -137.55 171.26 14.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.385 0.674 . . . . 0.0 110.603 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.72 134.2 15.39 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -173.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -155.67 -178.0 6.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.987 0.915 . . . . 0.0 110.047 -174.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.97 139.57 33.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 108.805 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -149.83 108.97 3.92 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.134 0.973 . . . . 0.0 108.844 -170.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm 59.99 32.36 21.07 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.243 1.017 . . . . 0.0 111.242 -177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.66 -17.83 56.77 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 115.27 -0.877 . . . . 0.0 113.55 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.88 111.95 21.98 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.043 0.537 . . . . 0.0 110.481 -177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.09 110.48 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 177.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -103.61 148.47 25.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.456 1.102 . . . . 0.0 109.833 -172.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -128.77 123.75 33.73 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -71.7 83.12 0.87 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -65.74 105.93 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.6 112.78 14.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 37.0 m95 -83.89 147.48 27.49 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 177.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 87.9 tttt -62.77 -53.86 47.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.714 0.806 . . . . 0.0 112.33 -166.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.57 1.12 83.67 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 54.5 m95 -116.86 134.99 22.9 Favored Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 123.218 0.607 . . . . 0.0 110.812 -171.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.99 167.68 25.35 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 123.276 2.651 . . . . 0.0 112.712 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -51.45 -28.63 28.49 Favored 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 123.855 3.037 . . . . 0.0 115.34 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -72.73 -28.4 62.63 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.494 0.318 . . . . 0.0 111.318 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -102.86 11.27 37.71 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.49 0.716 . . . . 0.0 111.069 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.443 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.7 m -86.97 137.34 32.44 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 167.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.3 p -110.94 139.22 46.47 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.366 0.666 . . . . 0.0 110.918 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.81 76.32 5.3 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.726 0.811 . . . . 0.0 110.031 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -91.48 122.37 66.02 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 123.55 0.74 . . . . 0.0 109.218 -178.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 19.1 Cg_exo -68.76 174.98 7.82 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.732 2.288 . . . . 0.0 112.95 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.69 -15.58 30.43 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.77 1.228 . . . . 0.0 112.268 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' A' ' 38' ' ' PRO . 40.6 mm-40 -55.35 -42.97 74.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.734 1.214 . . . . 0.0 110.922 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -105.13 -9.56 17.7 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.765 -171.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.584 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -71.92 112.24 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.596 HD12 ' HB ' ' B' ' 6' ' ' THR . 35.6 mt -71.07 -21.73 62.2 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -172.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -143.55 128.09 9.53 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 122.825 0.45 . . . . 0.0 110.198 -169.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.48 -35.11 98.89 Favored 'Trans proline' 0 C--N 1.38 2.19 0 C-N-CA 122.79 2.327 . . . . 0.0 112.91 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -67.57 -20.29 65.37 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.693 0.397 . . . . 0.0 111.839 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.584 HD23 HG23 ' A' ' 42' ' ' ILE . 24.0 tp -57.39 -42.78 82.89 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.054 0.388 . . . . 0.0 110.423 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 48.8 t -87.81 -46.74 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.663 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtt -63.7 -46.93 83.24 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.764 0.825 . . . . 0.0 112.53 -172.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.58 -33.44 75.61 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 123.642 0.589 . . . . 0.0 110.683 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.36 -48.47 81.62 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.507 0.504 . . . . 0.0 110.445 169.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' VAL . 46.2 mt-10 . . . . . 0 N--CA 1.485 1.292 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -173.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.522 ' HG3' ' HB2' ' A' ' 47' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 121.467 0.651 . . . . 0.0 111.401 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.596 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.0 m -148.86 162.08 40.56 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.899 1.28 . . . . 0.0 108.629 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.74 150.52 47.65 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.559 ' HA ' HG12 ' A' ' 4' ' ' VAL . 12.0 mmm-85 . . . . . 0 N--CA 1.471 0.581 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -178.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--O 1.247 0.963 0 CA-C-O 121.07 0.462 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.1 m -99.82 152.3 4.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.386 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -131.19 143.94 50.97 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.859 0.463 . . . . 0.0 110.172 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.19 110.21 4.46 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.175 175.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 18.5 m -97.13 154.56 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.768 0.427 . . . . 0.0 111.295 -172.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 36.1 tt0 -81.08 -69.83 0.58 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 170.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.9 m -166.21 -177.6 4.2 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.836 1.254 . . . . 0.0 109.487 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.9 mm -76.61 142.46 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 167.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.2 -46.69 4.36 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -143.04 165.07 28.38 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.489 1.116 . . . . 0.0 109.928 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -153.69 128.67 9.58 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.783 0.833 . . . . 0.0 108.775 -169.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.409 HH12 ' HD3' ' A' ' 16' ' ' ARG . 3.8 ptm180 -155.85 -174.3 4.9 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.218 1.007 . . . . 0.0 109.467 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -135.59 129.81 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HD3' HH12 ' A' ' 14' ' ' ARG . 54.2 ttp85 -133.74 119.39 19.23 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.151 0.98 . . . . 0.0 109.157 -178.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.86 27.76 16.13 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.403 1.081 . . . . 0.0 111.52 177.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.16 10.87 79.65 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.442 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 111.99 23.23 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 70.6 t -70.93 109.88 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -96.62 145.17 25.98 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.432 0.634 . . . . 0.0 110.095 -171.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.442 ' HB3' HD12 ' A' ' 10' ' ' ILE . 96.5 m-85 -127.21 111.49 14.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.589 -1.187 . . . . 0.0 107.869 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 tp -66.61 81.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 167.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.411 HG21 ' NE2' ' A' ' 41' ' ' HIS . 95.6 t -77.37 116.15 20.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -78.05 111.2 13.71 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 170.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 5.6 m95 -85.3 140.53 30.75 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 4.3 tppp? -58.0 -57.36 13.14 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -168.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.44 1.39 88.87 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.924 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 61.8 m95 -115.15 128.2 26.15 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.421 0.689 . . . . 0.0 109.918 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.72 175.67 6.92 Favored 'Trans proline' 0 CA--C 1.572 2.416 0 C-N-CA 123.32 2.68 . . . . 0.0 112.905 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -65.11 -13.36 39.37 Favored 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.607 2.204 . . . . 0.0 114.614 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -79.99 -8.72 59.5 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 122.187 -0.321 . . . . 0.0 111.423 173.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -114.9 -8.74 12.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.982 0.913 . . . . 0.0 111.778 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.6 p -64.25 117.02 6.59 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 169.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.5 p -122.87 148.2 45.7 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.958 0.409 . . . . 0.0 111.745 -169.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.74 87.46 4.64 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.646 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -102.51 133.74 20.34 Favored Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.25 166.57 26.5 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.236 2.624 . . . . 0.0 114.135 -171.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 12.4 pt-20 -49.58 -29.82 7.65 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.469 1.907 . . . . 0.0 114.785 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.24 -45.49 91.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.723 0.809 . . . . 0.0 111.55 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.53 ' HB2' ' HB2' ' B' ' 8' ' ' ARG . 2.1 p-80 -62.74 -17.22 60.51 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -172.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.69 111.69 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.315 0.646 . . . . 0.0 109.825 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.589 HD21 ' HG2' ' B' ' 8' ' ' ARG . 53.8 mt -81.8 -15.25 54.81 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 120.908 0.385 . . . . 0.0 111.453 -176.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -144.87 119.7 5.8 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 123.431 0.692 . . . . 0.0 109.662 -164.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.22 -34.19 79.19 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 122.584 2.189 . . . . 0.0 112.269 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' HB2' HE21 ' B' ' 5' ' ' GLN . 34.9 mtt85 -65.77 -20.11 66.14 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.174 0.99 . . . . 0.0 110.774 -173.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.1 tp -59.47 -52.03 67.34 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.444 1.098 . . . . 0.0 111.272 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 39.4 t -78.85 -35.0 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.299 0.639 . . . . 0.0 109.915 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.5 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.6 mmt -68.5 -28.83 67.36 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.526 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.9 -30.56 56.23 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 122.882 0.473 . . . . 0.0 111.328 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -61.03 -50.53 72.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.138 0.575 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 . . . . . 0 N--CA 1.476 0.84 0 C-N-CA 123.809 0.844 . . . . 0.0 111.53 -179.156 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.526 HE21 ' HB2' ' A' ' 46' ' ' ARG . 19.2 mp0 . . . . . 0 C--O 1.239 0.512 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -139.93 162.31 35.48 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 124.338 1.055 . . . . 0.0 109.813 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.519 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.78 141.66 24.71 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.831 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.589 ' HG2' HD21 ' A' ' 43' ' ' LEU . 19.5 mmt85 . . . . . 0 N--CA 1.485 1.3 0 C-N-CA 123.906 0.883 . . . . 0.0 111.849 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.444 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 85.5 mt-30 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 120.893 0.378 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.5 m -112.0 123.85 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.771 0.828 . . . . 0.0 109.152 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 21.8 m-85 -124.79 162.78 23.54 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.641 0.776 . . . . 0.0 109.588 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.87 112.78 4.47 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.334 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.54 HG21 HD13 ' A' ' 47' ' ' LEU . 32.7 m -74.55 154.34 6.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.283 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.7 tp10 -89.24 -64.96 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 166.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.2 m -165.01 175.2 9.68 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.827 1.251 . . . . 0.0 108.685 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.52 HD11 ' HG ' ' A' ' 47' ' ' LEU . 41.3 mm -78.95 117.71 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 162.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.525 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -72.46 -56.49 5.33 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.525 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.1 mttm -132.76 161.74 33.29 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.411 0.684 . . . . 0.0 110.956 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -146.54 136.55 23.46 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.414 1.085 . . . . 0.0 108.4 -176.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -159.79 177.55 10.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.045 0.538 . . . . 0.0 110.303 -173.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 20' ' ' VAL . 22.2 t -130.15 118.27 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 169.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.495 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 13.8 tpt85 -146.12 137.9 24.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.354 1.062 . . . . 0.0 108.895 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mtmt 64.99 25.05 12.68 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.278 1.031 . . . . 0.0 111.095 -178.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.05 4.83 84.14 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.876 -0.602 . . . . 0.0 113.411 -175.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -116.49 130.82 56.96 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.963 0.905 . . . . 0.0 110.312 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 15' ' ' VAL . 46.3 t -79.23 108.29 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 39.0 mt-10 -101.16 147.26 26.45 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.151 0.581 . . . . 0.0 110.356 -171.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -129.04 123.13 31.53 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.058 0.943 . . . . 0.0 108.902 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.6 tp -76.12 88.07 3.02 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 167.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.5 HG21 ' NE2' ' A' ' 41' ' ' HIS . 91.9 t -78.13 111.3 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.082 0.553 . . . . 0.0 110.116 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 4.9 tmtm? -83.18 132.4 35.07 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -106.36 135.2 48.26 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 19.9 ttmm -56.27 -59.97 4.18 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -165.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.27 17.98 25.69 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.437 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -122.92 134.7 25.2 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.211 1.004 . . . . 0.0 109.542 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -56.27 155.85 23.24 Favored 'Trans proline' 0 CA--C 1.567 2.125 0 C-N-CA 123.464 2.776 . . . . 0.0 113.378 -177.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -47.34 -38.27 26.25 Favored 'Trans proline' 0 C--N 1.383 2.376 0 C-N-CA 124.357 3.371 . . . . 0.0 116.029 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -81.8 -9.05 59.73 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -91.95 10.25 29.67 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.71 0.804 . . . . 0.0 111.53 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.8 m -71.2 137.9 49.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 169.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 p -119.78 147.52 44.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.863 0.465 . . . . 0.0 111.43 -171.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -94.43 119.59 33.38 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.962 0.905 . . . . 0.0 110.213 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -138.73 147.53 54.87 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 123.204 0.602 . . . . 0.0 109.631 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 16.0 Cg_exo -65.31 177.73 2.44 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 123.251 2.634 . . . . 0.0 113.12 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.54 -15.88 59.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.794 0.838 . . . . 0.0 112.587 -178.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.82 -23.76 66.75 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.847 1.259 . . . . 0.0 112.766 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.585 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 1.6 p-80 -89.37 -7.26 55.61 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.1 mm -71.08 112.93 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.559 0.744 . . . . 0.0 110.423 -175.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.6 mt -90.28 -10.82 42.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.013 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -150.69 131.01 6.97 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.637 -174.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -61.17 -33.0 91.47 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.174 2.583 . . . . 0.0 113.049 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 39.0 mmt180 -65.32 -15.73 62.84 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.381 0.672 . . . . 0.0 112.092 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.567 ' HB2' ' HB3' ' B' ' 5' ' ' GLN . 14.1 tp -64.57 -48.25 75.69 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.043 0.537 . . . . 0.0 110.737 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.32 -32.71 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.301 0.64 . . . . 0.0 110.251 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.595 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 52.7 mtt -61.57 -48.96 78.58 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.189 0.995 . . . . 0.0 111.396 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.74 -28.46 69.9 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.392 0.677 . . . . 0.0 111.475 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.87 -55.62 16.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.701 0.401 . . . . 0.0 110.984 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 . . . . . 0 N--CA 1.479 0.988 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.714 -170.798 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.567 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.8 mp0 . . . . . 0 CA--C 1.541 0.626 0 CA-C-O 121.545 0.688 . . . . 0.0 110.408 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 p -82.42 172.37 13.13 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 -170.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -162.8 133.6 4.79 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.859 -169.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? . . . . . 0 N--CA 1.494 1.764 0 C-N-CA 122.834 0.454 . . . . 0.0 110.075 175.96 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.565 0.221 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -97.92 153.38 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.987 0.915 . . . . 0.0 111.351 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.524 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 54.6 m-85 -137.46 156.77 47.78 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.568 1.147 . . . . 0.0 108.152 171.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 27' ' ' LYS . . . -68.81 125.67 27.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.35 0.66 . . . . 0.0 110.522 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.14 154.06 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.377 0.671 . . . . 0.0 110.25 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 12.7 tp10 -83.82 -69.52 0.63 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.4 m -158.86 -161.14 0.93 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.977 1.311 . . . . 0.0 108.16 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.449 HG23 ' HB3' ' A' ' 22' ' ' TYR . 48.1 mm -90.71 121.7 41.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.025 0.53 . . . . 0.0 109.98 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -77.41 -55.03 5.73 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.097 0.959 . . . . 0.0 109.836 -179.572 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -135.51 171.64 14.15 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.214 0.606 . . . . 0.0 110.552 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -155.81 143.31 19.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.023 0.529 . . . . 0.0 110.587 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -165.56 163.1 19.41 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.373 1.069 . . . . 0.0 108.556 175.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 14.0 p -101.31 137.82 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 168.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -153.39 127.99 9.37 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.292 0.637 . . . . 0.0 109.552 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.7 tptt 65.52 26.26 11.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.748 1.219 . . . . 0.0 111.077 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.82 3.71 90.44 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.524 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -119.27 119.16 33.24 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.759 0.824 . . . . 0.0 109.598 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 34.6 t -71.01 107.49 2.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 176.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 9.1 pt-20 -100.16 137.92 37.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.993 0.917 . . . . 0.0 109.72 -177.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.449 ' HB3' HG23 ' A' ' 10' ' ' ILE . 42.4 m-85 -116.75 123.19 46.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.115 -1.402 . . . . 0.0 107.838 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 tp -67.25 88.18 0.18 Allowed 'General case' 0 C--N 1.347 0.475 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 165.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.86 126.37 31.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 28.1 tptp -77.49 99.86 5.83 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.524 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 62.0 m95 -75.08 105.02 5.89 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 173.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HE2' ' HB1' ' A' ' 6' ' ' ALA . 65.5 pttt -70.31 -20.01 63.04 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -162.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.25 -13.06 79.85 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 123.002 0.189 . . . . 0.0 112.653 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -125.17 152.65 71.13 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 109.735 -170.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.03 165.1 33.49 Favored 'Trans proline' 0 CA--C 1.567 2.127 0 C-N-CA 122.455 2.103 . . . . 0.0 111.603 172.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.79 -20.64 69.92 Favored 'Trans proline' 0 C--N 1.391 2.804 0 C-N-CA 123.214 2.609 . . . . 0.0 113.793 -174.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -80.2 -29.16 38.57 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.391 0.277 . . . . 0.0 111.6 176.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -87.69 -6.49 58.2 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.044 0.538 . . . . 0.0 110.745 173.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' HD1' ' A' ' 26' ' ' TRP . 49.1 m -78.55 157.91 28.67 Favored 'General case' 0 C--N 1.353 0.754 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -139.37 155.18 47.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 120.612 0.244 . . . . 0.0 111.601 -164.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -87.27 92.25 9.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.2 1.0 . . . . 0.0 111.129 -175.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 8' ' ' ARG . 5.3 mp0 -104.78 121.49 46.66 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 124.243 1.017 . . . . 0.0 109.976 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 35.5 Cg_exo -61.44 174.42 2.1 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.933 2.422 . . . . 0.0 114.121 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.33 -13.81 61.11 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.546 -175.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -25.58 53.15 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.233 0.213 . . . . 0.0 111.377 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -80.04 -25.07 40.3 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.533 0.733 . . . . 0.0 111.4 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.643 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -68.37 127.82 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.045 0.938 . . . . 0.0 110.46 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.624 HD12 ' HB ' ' B' ' 6' ' ' THR . 56.9 mt -77.15 -64.09 1.22 Allowed 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.106 0.479 . . . . 0.0 110.956 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -100.65 133.5 21.18 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.498 -172.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -59.56 -30.82 93.33 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 123.219 2.613 . . . . 0.0 113.343 -175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.458 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 67.7 mtp180 -69.48 -16.04 63.38 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.58 0.752 . . . . 0.0 112.045 -176.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.643 HD23 HG23 ' A' ' 42' ' ' ILE . 20.2 tp -59.93 -43.57 94.87 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 120.968 0.413 . . . . 0.0 110.642 172.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 77.3 t -82.74 -48.89 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.417 175.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.458 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -65.66 -31.69 72.84 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.645 1.178 . . . . 0.0 113.303 -169.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.25 -37.46 69.12 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.829 0.347 . . . . 0.0 110.884 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -66.13 -39.16 89.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.507 0.723 . . . . 0.0 110.344 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 . . . . . 0 N--CA 1.474 0.743 0 C-N-CA 123.683 0.793 . . . . 0.0 111.836 178.285 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.518 ' HB3' HD13 ' A' ' 47' ' ' LEU . 84.6 mm-40 . . . . . 0 C--O 1.242 0.66 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.624 ' HB ' HD12 ' A' ' 43' ' ' LEU . 30.9 m -150.75 157.72 43.29 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 124.003 0.921 . . . . 0.0 109.03 -173.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.81 161.95 36.74 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.953 0.901 . . . . 0.0 109.702 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 37' ' ' GLU . 5.2 mpt_? . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 168.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 . . . . . 0 CA--C 1.542 0.669 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.578 HG12 ' HG2' ' B' ' 8' ' ' ARG . 31.1 m -101.89 137.76 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.583 0.753 . . . . 0.0 109.788 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -134.21 159.94 39.39 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 124.062 0.945 . . . . 0.0 109.29 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.59 144.3 32.49 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.951 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.456 HG21 HD13 ' A' ' 47' ' ' LEU . 22.7 m -91.09 154.81 3.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.099 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.5 tt0 -82.88 -57.89 3.11 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 160.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -163.52 177.65 8.65 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.917 1.287 . . . . 0.0 109.351 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.1 mm -81.2 114.94 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 162.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -54.84 18.3 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.75 0.82 . . . . 0.0 109.453 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -143.59 169.82 17.0 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.8 0.84 . . . . 0.0 111.092 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -149.23 135.41 19.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.53 1.132 . . . . 0.0 108.888 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -160.74 175.51 12.53 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.556 0.743 . . . . 0.0 109.16 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -117.94 114.84 46.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 CA-C-O 121.511 0.672 . . . . 0.0 109.573 170.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -105.9 97.67 7.46 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 124.878 1.271 . . . . 0.0 109.678 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 62.16 41.88 10.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 172.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.13 -15.11 63.67 Favored Glycine 0 N--CA 1.472 1.097 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.301 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm -88.4 109.93 20.41 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.435 0.694 . . . . 0.0 109.2 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.29 106.14 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 77.5 mt-10 -114.09 150.19 34.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.718 -168.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -122.6 116.7 24.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.438 -1.71 . . . . 0.0 108.2 -176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.0 tp -69.22 104.27 2.16 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.431 HG21 ' NE2' ' A' ' 41' ' ' HIS . 14.8 t -94.08 108.68 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -170.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -76.89 120.73 22.43 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.1 m95 -93.24 153.26 18.7 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.12 0.568 . . . . 0.0 110.433 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -70.98 -9.27 57.69 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -163.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -149.47 24.17 1.21 Allowed Glycine 0 N--CA 1.474 1.221 0 CA-C-N 117.937 0.335 . . . . 0.0 112.342 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 51.0 m95 -123.4 136.9 27.65 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 124.131 0.972 . . . . 0.0 108.484 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -59.13 159.76 21.12 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 122.941 2.427 . . . . 0.0 112.959 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -53.39 -30.2 51.78 Favored 'Trans proline' 0 C--N 1.382 2.297 0 C-N-CA 123.393 2.729 . . . . 0.0 114.278 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.1 -15.02 58.76 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -99.85 17.24 21.3 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.598 0.759 . . . . 0.0 111.698 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -81.1 141.19 34.54 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.2 p -110.19 130.13 55.6 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -169.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.58 96.46 1.97 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.838 0.455 . . . . 0.0 109.986 170.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -123.47 131.58 24.29 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.155 0.982 . . . . 0.0 109.92 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.594 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 84.4 Cg_endo -70.59 170.63 17.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.131 2.554 . . . . 0.0 113.672 -175.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -53.39 -17.11 1.67 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.847 1.259 . . . . 0.0 114.316 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.29 -39.24 89.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.933 0.893 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.47 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 9.3 p-80 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.806 0.442 . . . . 0.0 111.996 -177.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.8 mm -67.85 116.01 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 124.324 1.049 . . . . 0.0 110.515 -175.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.2 mt -99.22 8.55 44.7 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.954 0.502 . . . . 0.0 111.348 -176.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -150.08 118.98 3.7 Favored Pre-proline 0 N--CA 1.483 1.199 0 C-N-CA 123.581 0.753 . . . . 0.0 109.714 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.47 -36.8 52.55 Favored 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 122.954 2.436 . . . . 0.0 112.576 -177.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -65.12 -22.33 66.92 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 125.221 1.408 . . . . 0.0 111.469 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.456 HD13 HG21 ' A' ' 7' ' ' VAL . 16.9 tp -59.56 -52.17 66.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.816 0.846 . . . . 0.0 111.375 174.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.88 -42.23 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.569 0.699 . . . . 0.0 111.02 178.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -74.46 -26.81 60.27 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.649 -171.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.93 -29.05 55.47 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.126 0.571 . . . . 0.0 111.11 175.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -59.44 -45.75 90.7 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.529 0.731 . . . . 0.0 109.953 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 . . . . . 0 N--CA 1.475 0.818 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.581 178.025 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--O 1.237 0.417 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.4 p -76.06 148.39 38.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.268 -176.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.47 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.94 132.3 16.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.824 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG2' HG12 ' A' ' 4' ' ' VAL . 23.4 mtm180 . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.207 0.603 . . . . 0.0 111.074 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.483 1.205 0 CA-C-O 120.276 0.084 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.4 HG12 ' HG2' ' B' ' 8' ' ' ARG . 35.5 m -85.5 138.62 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.688 0.795 . . . . 0.0 110.756 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -131.12 157.61 42.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.764 0.826 . . . . 0.0 109.771 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.17 107.22 10.6 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 123.578 0.751 . . . . 0.0 109.333 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.91 154.2 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.832 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.1 tt0 -93.44 -52.94 4.27 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.409 0.683 . . . . 0.0 109.668 177.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -161.93 168.21 23.3 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.67 1.188 . . . . 0.0 109.839 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.459 HD13 HG22 ' A' ' 24' ' ' VAL . 32.4 mm -77.28 115.07 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 162.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.437 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -69.86 -58.61 3.67 Favored 'General case' 0 CA--C 1.556 1.177 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.082 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.437 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.0 mtpp -139.08 171.48 14.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.978 0.911 . . . . 0.0 110.994 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -154.32 133.05 12.2 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.651 1.18 . . . . 0.0 108.569 -171.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -160.23 179.57 8.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.981 0.913 . . . . 0.0 110.074 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 8.9 p -129.81 138.04 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.461 0.704 . . . . 0.0 109.966 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -138.74 100.68 4.13 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.503 1.121 . . . . 0.0 108.904 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 60.59 36.86 19.71 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.127 0.971 . . . . 0.0 111.43 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.58 -10.77 73.52 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.2 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -99.8 108.84 21.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.218 0.607 . . . . 0.0 110.18 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 59.9 t -76.95 112.31 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.608 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -96.27 139.3 32.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.669 0.788 . . . . 0.0 109.835 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -118.72 110.18 16.96 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.7 tp -69.84 105.37 2.76 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 167.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.584 HG21 ' HE1' ' A' ' 41' ' ' HIS . 76.2 t -101.05 118.88 48.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -77.39 115.66 17.34 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 171.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 11.1 m95 -90.38 144.44 25.81 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 30.5 ttmt -64.23 -53.85 42.75 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -166.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.83 1.46 86.28 Favored Glycine 0 CA--C 1.533 1.172 0 N-CA-C 113.798 0.279 . . . . 0.0 113.798 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.6 m95 -114.81 135.8 22.44 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.741 0.816 . . . . 0.0 109.322 -177.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -64.51 160.7 38.41 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 C-N-CA 122.467 2.111 . . . . 0.0 112.038 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.52 -22.25 21.22 Favored 'Trans proline' 0 C--N 1.384 2.416 0 C-N-CA 123.531 2.821 . . . . 0.0 114.48 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -77.39 -35.78 54.03 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.507 0.323 . . . . 0.0 111.489 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -82.9 0.38 44.58 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.071 0.549 . . . . 0.0 111.242 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.1 m -70.67 140.83 51.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.43 0.692 . . . . 0.0 109.669 171.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -132.06 156.49 46.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.267 0.627 . . . . 0.0 111.811 -167.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -95.41 112.28 24.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.528 1.131 . . . . 0.0 109.351 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.3 mp0 -116.95 144.39 33.41 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.612 0.765 . . . . 0.0 109.435 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.82 160.5 49.42 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 123.081 2.521 . . . . 0.0 112.171 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -50.33 -28.59 8.17 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 125.921 1.688 . . . . 0.0 114.629 -167.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.748 ' HG2' HH22 ' B' ' 8' ' ' ARG . 39.4 tt0 -64.1 -30.11 71.2 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.587 0.755 . . . . 0.0 112.224 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.584 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.1 p80 -64.1 -22.52 66.97 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.48 114.24 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.18 0.592 . . . . 0.0 109.53 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.3 mt -85.04 -63.88 1.25 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -77.75 118.37 71.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.003 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.79 -25.61 39.38 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.501 2.134 . . . . 0.0 111.961 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -70.98 -16.69 62.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.667 0.787 . . . . 0.0 111.03 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' B' ' 5' ' ' GLN . 14.5 tp -60.48 -52.92 63.16 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.964 . . . . 0.0 111.255 172.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.2 t -76.35 -38.65 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.274 0.63 . . . . 0.0 109.764 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtm -67.95 -27.99 67.08 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.229 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.24 -43.85 49.3 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.976 0.353 . . . . 0.0 110.051 175.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -56.19 -54.81 40.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.056 0.542 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 . . . . . 0 N--CA 1.479 0.989 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.971 179.9 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.486 ' HB2' HD13 ' A' ' 47' ' ' LEU . 21.7 pt20 . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 11.2 m -127.11 141.65 51.71 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.279 0.632 . . . . 0.0 110.37 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.84 148.76 31.23 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.136 0.974 . . . . 0.0 109.819 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.748 HH22 ' HG2' ' A' ' 40' ' ' GLU . 70.3 mtm-85 . . . . . 0 N--CA 1.478 0.959 0 C-N-CA 123.218 0.607 . . . . 0.0 110.783 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.494 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.3 mp0 . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 120.282 0.087 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 m -115.72 125.61 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.948 0.899 . . . . 0.0 110.439 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.494 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 83.4 m-85 -122.36 155.89 35.08 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.011 0.524 . . . . 0.0 110.499 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.45 110.32 3.08 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.072 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.624 HG21 HD13 ' A' ' 47' ' ' LEU . 16.4 m -84.16 154.66 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.54 0.736 . . . . 0.0 110.391 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.2 tt0 -91.23 -65.64 1.0 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 171.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.3 m -163.44 175.51 10.7 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.329 1.452 . . . . 0.0 108.251 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.509 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.7 mm -74.78 119.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 165.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -74.19 -45.04 50.93 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -156.38 159.69 38.98 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.237 0.615 . . . . 0.0 109.928 -175.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -149.91 147.55 28.05 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.328 0.651 . . . . 0.0 109.905 -172.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -168.2 -173.99 2.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.22 1.008 . . . . 0.0 109.323 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -126.56 123.13 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.737 0.815 . . . . 0.0 108.893 173.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -150.07 150.35 31.6 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.93 24.85 13.78 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.625 1.17 . . . . 0.0 111.128 -173.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.71 16.05 67.38 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-N 116.102 -0.499 . . . . 0.0 113.235 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -126.7 145.85 50.43 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.466 1.106 . . . . 0.0 109.219 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.18 112.5 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -96.08 140.67 30.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.406 0.683 . . . . 0.0 109.977 -175.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HB3' HD12 ' A' ' 10' ' ' ILE . 93.3 m-85 -125.97 109.8 12.87 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.993 0.917 . . . . 0.0 109.077 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.7 tp -68.87 89.44 0.4 Allowed 'General case' 0 C--N 1.344 0.355 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.546 HG21 ' NE2' ' A' ' 41' ' ' HIS . 89.9 t -85.93 115.98 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 122.85 0.46 . . . . 0.0 109.886 -174.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -79.23 111.38 15.41 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.3 m95 -83.41 130.01 35.02 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.9 ttpt -62.09 -51.23 68.77 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.08 8.78 59.5 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 123.204 0.315 . . . . 0.0 113.658 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 65.8 m95 -123.42 137.96 29.33 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.084 0.954 . . . . 0.0 109.338 -174.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.506 ' HG2' ' CD1' ' A' ' 33' ' ' TYR . 29.7 Cg_endo -63.87 153.7 74.13 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 122.946 2.431 . . . . 0.0 113.212 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -38.53 -47.95 2.55 Favored 'Trans proline' 0 C--N 1.389 2.707 1 C-N-CA 125.888 4.392 . . . . 0.0 117.293 -171.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -72.36 -17.58 61.82 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -171.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.506 ' CD1' ' HG2' ' A' ' 30' ' ' PRO . 76.8 m-85 -84.6 7.54 19.82 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.246 0.618 . . . . 0.0 111.961 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.6 p -68.49 124.24 23.03 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 167.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 p -112.33 142.15 45.19 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.158 0.583 . . . . 0.0 111.086 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -77.14 81.71 3.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.784 0.834 . . . . 0.0 109.17 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -94.08 127.51 44.69 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.174 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.43 175.84 9.52 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.425 2.083 . . . . 0.0 113.263 -173.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.07 -34.2 9.27 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.794 1.637 . . . . 0.0 113.797 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -58.58 -30.02 66.86 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.737 1.215 . . . . 0.0 112.934 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.568 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.0 p-80 -84.48 -16.76 41.34 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -170.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.4 mm -67.31 123.37 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.065 0.546 . . . . 0.0 109.882 -176.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.554 HD21 ' HG2' ' B' ' 8' ' ' ARG . 30.0 mt -99.22 -44.82 6.11 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.822 0.344 . . . . 0.0 110.469 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 26.3 t70 -110.74 129.27 24.14 Favored Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.67 -176.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.26 -27.03 41.38 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 123.107 2.538 . . . . 0.0 113.571 -175.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.659 ' HB2' HE21 ' B' ' 5' ' ' GLN . 41.4 mmt180 -70.13 -15.68 63.0 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.947 0.499 . . . . 0.0 111.507 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.624 HD13 HG21 ' A' ' 7' ' ' VAL . 18.9 tp -58.91 -44.43 91.25 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.549 0.74 . . . . 0.0 110.368 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -89.13 -35.9 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.316 0.646 . . . . 0.0 110.664 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.598 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 75.8 mmm -68.76 -33.94 74.74 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.028 0.931 . . . . 0.0 112.243 -175.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.07 -28.42 63.32 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.582 0.353 . . . . 0.0 110.497 175.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -75.24 -45.42 40.26 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.242 1.017 . . . . 0.0 111.65 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 . . . . . 0 N--CA 1.475 0.823 0 C-N-CA 122.855 0.462 . . . . 0.0 111.059 -175.202 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.659 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.4 mp0 . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 5.1 p -122.98 162.91 21.41 Favored 'General case' 0 C--O 1.248 1.021 0 C-N-CA 124.079 0.952 . . . . 0.0 110.22 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.568 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -157.19 126.69 6.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.408 -172.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.554 ' HG2' HD21 ' A' ' 43' ' ' LEU . 14.8 mmt85 . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 172.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.701 0.286 . . . . 0.0 111.707 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.78 140.1 18.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.126 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -134.29 141.7 47.04 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 171.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.13 113.19 4.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.294 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.45 HG22 ' O ' ' B' ' 5' ' ' GLN . 15.9 m -90.07 154.55 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.019 0.527 . . . . 0.0 111.132 -173.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -84.18 -68.98 0.67 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 168.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -159.4 -179.6 8.09 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mm -83.0 121.36 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -60.21 2.35 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.252 1.021 . . . . 0.0 108.54 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -137.67 169.82 17.13 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.956 0.902 . . . . 0.0 110.523 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -153.65 128.17 9.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.814 0.846 . . . . 0.0 109.083 -170.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -162.61 -173.74 3.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.222 1.009 . . . . 0.0 110.104 -176.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.38 143.89 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.148 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 4.1 ttm180 -147.98 115.07 6.16 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.108 0.963 . . . . 0.0 108.614 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 55.5 mtpt 63.84 32.43 13.39 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.159 0.984 . . . . 0.0 111.851 172.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.47 -15.15 63.01 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.261 -0.881 . . . . 0.0 113.021 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -96.58 110.68 23.04 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.689 0.796 . . . . 0.0 109.588 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.98 109.49 8.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -97.62 137.97 35.73 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 122.747 0.419 . . . . 0.0 110.32 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -115.51 110.22 18.95 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 167.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.1 tp -67.13 101.79 0.94 Allowed 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.476 HG21 ' HE1' ' A' ' 41' ' ' HIS . 71.9 t -97.42 122.62 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 122.221 0.209 . . . . 0.0 111.092 -172.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -78.57 119.46 21.87 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -89.0 140.55 29.32 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.97 0.908 . . . . 0.0 109.429 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -62.0 -51.46 67.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.063 0.545 . . . . 0.0 112.399 -168.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.43 9.14 78.12 Favored Glycine 0 C--N 1.346 1.084 0 N-CA-C 114.071 0.388 . . . . 0.0 114.071 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.9 m95 -127.84 137.62 31.15 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -175.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -64.2 159.01 45.27 Favored 'Trans proline' 0 C--N 1.377 2.044 0 C-N-CA 122.608 2.205 . . . . 0.0 111.812 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -60.09 -11.73 16.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.61 2.873 . . . . 0.0 115.708 -171.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -80.32 -18.32 49.51 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 118.851 0.75 . . . . 0.0 111.323 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -88.91 2.22 54.13 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.739 0.815 . . . . 0.0 111.407 172.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 t -64.13 123.53 19.3 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.2 p -119.1 156.82 29.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.689 0.796 . . . . 0.0 110.912 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -95.17 116.21 28.43 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.785 0.834 . . . . 0.0 108.833 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -119.5 149.76 48.49 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 123.497 0.719 . . . . 0.0 109.381 171.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.16 149.56 81.89 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 121.943 1.762 . . . . 0.0 110.409 168.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -56.6 -16.38 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.522 1.129 . . . . 0.0 113.991 -168.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.63 -28.44 65.66 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.757 1.223 . . . . 0.0 112.477 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.476 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.2 p80 -72.9 -15.6 61.58 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.504 HG21 HG23 ' A' ' 48' ' ' VAL . 37.4 mm -69.89 120.37 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 123.599 0.759 . . . . 0.0 109.666 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.509 HD21 ' HG3' ' B' ' 8' ' ' ARG . 26.0 mt -86.58 -15.41 39.94 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.616 0.366 . . . . 0.0 111.344 -177.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -147.9 125.86 5.91 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.201 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -55.61 -31.74 80.45 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.785 2.99 . . . . 0.0 113.86 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.452 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.3 mmt180 -65.22 -16.8 63.93 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.413 HD13 HG21 ' A' ' 7' ' ' VAL . 13.3 tp -69.61 -48.42 60.15 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.182 0.593 . . . . 0.0 110.595 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.504 HG23 HG21 ' A' ' 42' ' ' ILE . 26.1 t -69.01 -39.47 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 CA-C-O 121.439 0.638 . . . . 0.0 109.903 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 93.5 mtp -69.81 -32.57 71.09 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 114.328 -1.305 . . . . 0.0 111.236 -176.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -28.62 69.84 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.357 0.663 . . . . 0.0 111.639 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -64.48 -55.31 21.55 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.486 0.714 . . . . 0.0 110.85 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 N--CA 1.484 1.266 0 C-N-CA 123.357 0.663 . . . . 0.0 110.462 -173.841 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.45 ' O ' HG22 ' A' ' 7' ' ' VAL . 5.2 pm0 . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -136.43 165.74 25.11 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 123.881 0.872 . . . . 0.0 110.796 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.439 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -153.44 140.08 18.89 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.671 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.509 ' HG3' HD21 ' A' ' 43' ' ' LEU . 70.0 mtm180 . . . . . 0 N--CA 1.476 0.829 0 C-N-CA 123.02 0.528 . . . . 0.0 109.673 174.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.5 m -82.73 138.07 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 122.989 0.516 . . . . 0.0 110.58 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -135.06 146.1 48.61 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 123.832 0.853 . . . . 0.0 108.947 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.65 120.61 13.76 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.742 0.817 . . . . 0.0 109.55 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 9.5 m -95.78 153.48 3.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 C-N-CA 123.03 0.532 . . . . 0.0 110.183 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 36.0 tt0 -86.57 -65.59 1.0 Allowed 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 170.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -158.79 -179.27 7.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.373 1.069 . . . . 0.0 109.168 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -88.93 121.88 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 163.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -62.4 1.65 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -125.15 171.58 10.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.434 0.694 . . . . 0.0 111.476 -176.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -155.27 144.44 20.94 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 109.68 -173.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -168.56 -175.98 2.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.259 1.024 . . . . 0.0 109.41 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.14 127.9 20.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 52.2 ttt-85 -140.69 125.81 18.49 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HG2' ' HG2' ' A' ' 16' ' ' ARG . 72.7 mmtt 64.44 25.16 13.3 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.48 1.112 . . . . 0.0 111.507 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.65 74.53 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.156 -0.474 . . . . 0.0 113.204 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -89.89 110.6 21.54 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.021 0.928 . . . . 0.0 108.905 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 t -77.88 105.47 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.71 137.3 36.82 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.264 0.626 . . . . 0.0 110.019 -169.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -126.51 112.57 15.72 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.9 tp -69.2 86.91 0.4 Allowed 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.34 112.6 6.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 C-N-CA 123.199 0.6 . . . . 0.0 109.656 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -77.55 110.53 12.43 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 171.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.3 m95 -82.71 153.71 25.19 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 39.6 ttmt -70.8 -60.84 2.02 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.138 0.575 . . . . 0.0 112.33 -167.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.07 6.83 77.84 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 116.252 -0.431 . . . . 0.0 113.13 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.9 m95 -118.06 134.64 23.31 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.223 1.009 . . . . 0.0 109.072 -177.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.83 171.4 12.29 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.795 2.33 . . . . 0.0 111.858 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.5 -14.53 44.89 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 122.78 2.32 . . . . 0.0 113.664 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -83.28 -6.72 59.57 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.303 0.641 . . . . 0.0 112.227 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -114.94 13.22 17.0 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.031 0.932 . . . . 0.0 110.613 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.2 m -82.37 133.42 35.22 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 27.3 p -116.16 143.39 45.56 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.912 0.885 . . . . 0.0 110.494 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -71.09 82.12 0.69 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 170.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -101.33 109.48 58.92 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.551 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.45 162.95 31.59 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.537 2.158 . . . . 0.0 113.336 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -54.05 -26.55 27.2 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.178 1.391 . . . . 0.0 112.165 174.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -56.27 -31.88 64.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.275 1.43 . . . . 0.0 111.628 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -113.36 -10.93 13.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.887 0.875 . . . . 0.0 112.097 -174.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 44.3 mm -65.61 141.63 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 170.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.9 pp -113.38 -12.25 13.03 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.812 1.187 . . . . 0.0 112.214 178.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -101.26 117.02 63.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 173.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.12 -38.0 93.31 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.438 2.092 . . . . 0.0 110.323 166.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 21.2 mmm180 -62.3 -23.25 66.63 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.194 0.998 . . . . 0.0 113.292 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 19.5 tp -66.52 -52.52 44.93 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 118.26 0.482 . . . . 0.0 110.674 178.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 90.7 t -72.94 -37.61 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.034 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.408 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 61.4 mtt -60.5 -38.83 85.59 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.705 0.802 . . . . 0.0 111.268 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.06 -33.96 76.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.577 0.751 . . . . 0.0 110.581 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -69.06 -41.27 77.82 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.344 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.0 mm-40 . . . . . 0 N--CA 1.486 1.334 0 C-N-CA 122.74 0.416 . . . . 0.0 110.845 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 . . . . . 0 CA--C 1.551 1.018 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.589 ' HB ' HD11 ' A' ' 43' ' ' LEU . 27.2 m -150.72 145.15 25.61 Favored 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 123.99 0.916 . . . . 0.0 111.278 -169.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -131.36 149.66 52.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.082 0.953 . . . . 0.0 109.615 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.46 ' HG3' HD23 ' A' ' 43' ' ' LEU . 78.9 mtm180 . . . . . 0 N--CA 1.474 0.727 0 C-N-CA 124.075 0.95 . . . . 0.0 108.921 175.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 . . . . . 0 CA--C 1.545 0.782 0 CA-C-O 121.121 0.486 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.53 143.25 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.842 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -139.93 150.59 44.73 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.063 0.945 . . . . 0.0 109.702 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.91 131.12 45.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.925 176.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.5 m -116.46 154.27 18.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.129 0.571 . . . . 0.0 111.383 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 26.3 tt0 -85.14 -58.79 2.54 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.441 1.096 . . . . 0.0 108.503 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.8 m -174.95 -178.65 1.27 Allowed 'General case' 0 C--O 1.243 0.751 0 C-N-CA 126.525 1.93 . . . . 0.0 108.025 178.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.517 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 45.0 mm -78.18 124.5 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -61.14 1.9 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.64 0.776 . . . . 0.0 109.123 176.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.429 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 67.4 mttm -133.99 156.64 47.82 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.856 0.863 . . . . 0.0 110.148 178.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -145.68 141.72 28.35 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.425 0.69 . . . . 0.0 109.466 -176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -165.21 -173.17 2.77 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.398 1.079 . . . . 0.0 109.357 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -135.39 119.33 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.408 0.623 . . . . 0.0 110.359 175.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -102.21 97.62 7.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.187 0.995 . . . . 0.0 108.731 173.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp 56.58 52.75 9.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.357 1.063 . . . . 0.0 113.096 168.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 -3.19 85.85 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.731 -0.668 . . . . 0.0 113.561 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -111.89 111.76 22.94 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 36.9 t -77.77 112.94 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -96.8 138.06 34.93 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.13 0.972 . . . . 0.0 109.876 -171.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.5 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.0 m-85 -127.74 110.14 12.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.162 0.985 . . . . 0.0 109.246 -178.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.429 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.5 tp -69.68 101.69 1.72 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.935 -1.505 . . . . 0.0 106.935 165.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 41' ' ' HIS . 25.6 t -93.21 117.72 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 122.495 0.318 . . . . 0.0 110.383 -171.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -80.13 110.9 15.97 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 56.9 m95 -85.55 77.67 9.82 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.131 0.491 . . . . 0.0 109.895 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 85.2 tttt 52.56 -91.15 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.907 1.683 . . . . 0.0 113.022 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -121.61 14.17 9.27 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 122.877 0.275 . . . . 0.0 113.037 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 25.4 m95 -70.84 129.17 90.01 Favored Pre-proline 0 N--CA 1.473 0.698 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 171.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.42 146.4 62.76 Favored 'Trans proline' 0 C--N 1.379 2.15 0 C-N-CA 122.866 2.377 . . . . 0.0 112.068 -175.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -44.74 -29.08 3.25 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 124.623 3.549 . . . . 0.0 116.865 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -74.37 -7.46 52.95 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -104.98 0.98 28.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.998 0.919 . . . . 0.0 111.745 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.6 p -71.94 123.29 22.4 Favored 'General case' 0 C--N 1.351 0.666 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 171.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.0 p -114.42 139.3 49.61 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 0.0 111.934 -169.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -77.49 86.3 3.85 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.328 1.051 . . . . 0.0 110.06 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -101.52 137.78 19.7 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.012 0.925 . . . . 0.0 109.916 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.11 161.41 26.4 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 122.208 1.938 . . . . 0.0 112.634 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -38.37 -33.08 0.09 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 127.291 2.236 . . . . 0.0 116.196 -171.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.78 -30.03 70.14 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.05 0.94 . . . . 0.0 112.635 -172.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 24' ' ' VAL . 6.5 p-80 -71.77 -12.54 61.35 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.8 mm -71.54 128.95 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.086 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.577 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.6 pp -108.52 -4.49 17.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 119.818 1.19 . . . . 0.0 112.853 176.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.9 p-10 -139.58 153.99 70.92 Favored Pre-proline 0 N--CA 1.481 1.081 0 C-N-CA 122.482 0.313 . . . . 0.0 111.484 -171.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -67.66 -40.15 10.58 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.226 1.951 . . . . 0.0 112.793 176.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -61.25 -28.22 69.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.853 0.861 . . . . 0.0 113.116 -165.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.43 -52.46 32.47 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.451 0.7 . . . . 0.0 112.496 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.11 -36.15 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-O 121.43 0.633 . . . . 0.0 110.391 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mtp -74.53 -28.34 60.92 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.319 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.48 -37.81 88.84 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.378 0.671 . . . . 0.0 110.995 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.9 t80 -54.52 -51.79 64.04 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.348 1.059 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 . . . . . 0 N--CA 1.473 0.707 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.929 -174.301 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 . . . . . 0 C--O 1.247 0.968 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 43' ' ' LEU . 28.4 m -149.33 153.2 37.1 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.288 1.042 . . . . 0.0 110.805 -167.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -142.96 150.05 39.18 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.554 -178.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.409 ' CZ ' ' HB3' ' A' ' 43' ' ' LEU . 2.2 mpt_? . . . . . 0 N--CA 1.478 0.974 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 . . . . . 0 CA--C 1.547 0.836 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.407 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.7 m -90.59 143.57 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.64 0.776 . . . . 0.0 110.503 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -139.61 138.18 35.96 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.643 0.777 . . . . 0.0 110.589 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.87 115.21 20.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 164.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.0 m -105.59 158.04 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.334 0.654 . . . . 0.0 111.576 -165.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.88 -56.14 8.86 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.773 0.67 . . . . 0.0 111.21 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -162.02 177.5 9.7 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.942 0.897 . . . . 0.0 110.225 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -83.83 119.61 33.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 157.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.497 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.7 tmt_? -71.42 -62.94 1.23 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.497 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.4 mttt -128.09 160.16 32.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.68 0.792 . . . . 0.0 110.61 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -146.34 140.23 26.25 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.815 1.246 . . . . 0.0 107.788 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -163.89 -175.57 4.14 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.127 0.571 . . . . 0.0 110.03 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.7 p -139.26 124.02 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.434 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 79.0 ttt180 -123.14 106.04 10.43 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.215 1.406 . . . . 0.0 108.569 -173.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 16' ' ' ARG . 37.3 mtmt 65.95 25.49 11.07 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.758 1.223 . . . . 0.0 111.702 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.43 -13.94 66.43 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.603 -0.271 . . . . 0.0 113.0 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -84.76 110.96 19.18 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.242 0.617 . . . . 0.0 110.275 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.525 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 41.1 t -73.2 111.57 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -107.58 144.43 34.62 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.435 0.694 . . . . 0.0 110.864 -171.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -130.2 113.92 15.05 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.042 0.937 . . . . 0.0 110.255 -175.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.2 tp -74.56 93.83 2.56 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 166.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 59.6 t -87.36 116.12 29.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 C-N-CA 122.69 0.396 . . . . 0.0 110.406 -173.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -74.92 113.68 12.5 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.156 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.9 m95 -84.54 132.97 34.46 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.011 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -81.97 110.62 17.39 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 123.475 0.485 . . . . 0.0 109.886 -172.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 113.16 -16.96 22.29 Favored Glycine 0 N--CA 1.473 1.108 0 O-C-N 123.724 0.64 . . . . 0.0 111.681 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 20.6 m95 -107.83 130.54 22.67 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 123.963 0.905 . . . . 0.0 108.901 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 23.8 Cg_endo -59.96 154.61 49.43 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.444 2.096 . . . . 0.0 112.599 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -51.22 -17.8 4.31 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 124.605 3.536 . . . . 0.0 116.166 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -79.96 -35.43 37.65 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.678 0.391 . . . . 0.0 111.138 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.446 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 41.9 m-85 -77.88 -11.36 59.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.468 0.707 . . . . 0.0 111.064 173.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.2 t -61.55 132.29 52.88 Favored 'General case' 0 C--N 1.358 0.972 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.1 p -127.72 164.14 22.78 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.075 0.55 . . . . 0.0 111.572 -170.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -100.16 116.59 32.54 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.39 1.076 . . . . 0.0 109.826 -172.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.41 153.37 72.29 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 168.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.59 -177.51 3.41 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.355 2.037 . . . . 0.0 114.214 -174.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.525 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 9.8 pt-20 -52.02 -31.43 29.78 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.267 1.827 . . . . 0.0 112.687 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.65 -45.99 92.02 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.721 1.208 . . . . 0.0 112.214 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 1.1 p-80 -75.52 -13.7 60.37 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -170.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.8 mm -66.87 104.84 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 175.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.569 HD12 ' HB ' ' B' ' 6' ' ' THR . 20.3 mt -90.39 -51.9 5.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.98 125.46 83.82 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.034 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.44 -37.52 13.14 Favored 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 122.901 2.401 . . . . 0.0 112.313 177.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -63.03 -21.76 66.38 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.764 0.826 . . . . 0.0 111.727 -177.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.1 -50.89 71.89 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.97 0.908 . . . . 0.0 111.618 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 46.8 t -80.24 -43.4 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.967 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.7 mtt -59.68 -45.38 92.26 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.301 1.04 . . . . 0.0 112.412 -175.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -27.27 63.33 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.218 0.607 . . . . 0.0 111.143 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.21 -37.54 78.12 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.616 0.366 . . . . 0.0 110.938 172.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.0 mm-40 . . . . . 0 N--CA 1.477 0.899 0 O-C-N 123.082 0.239 . . . . 0.0 111.265 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 . . . . . 0 N--CA 1.47 0.551 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.569 ' HB ' HD12 ' A' ' 43' ' ' LEU . 10.8 p -78.99 119.91 22.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.691 -173.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.71 123.6 18.83 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.099 1.36 . . . . 0.0 108.523 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 41' ' ' HIS . 17.8 mtm-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 119.1 -0.476 . . . . 0.0 109.934 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 . . . . . 0 CA--C 1.543 0.691 0 CA-C-O 121.002 0.429 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.93 127.34 38.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-O 121.041 0.448 . . . . 0.0 111.086 -177.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.26 162.98 20.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.838 0.855 . . . . 0.0 109.173 174.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.54 107.42 5.05 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.281 0.633 . . . . 0.0 110.491 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 9.6 m -75.93 154.09 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.382 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.52 -66.03 0.93 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 163.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.4 m -164.64 -162.34 0.64 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.156 1.782 . . . . 0.0 107.421 174.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -85.38 137.22 21.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 164.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.567 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.8 tmt_? -88.9 -54.3 4.2 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -137.17 163.94 29.67 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.503 0.721 . . . . 0.0 110.618 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -151.49 143.54 23.92 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.144 0.977 . . . . 0.0 108.483 -173.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -164.42 168.0 18.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.683 0.793 . . . . 0.0 110.179 -176.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 20' ' ' VAL . 21.8 t -116.0 125.29 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -123.54 94.9 4.38 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.295 1.038 . . . . 0.0 108.701 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.58 39.15 27.9 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.322 1.049 . . . . 0.0 111.353 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.93 -18.27 57.02 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.371 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -90.9 108.08 19.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.979 0.512 . . . . 0.0 109.688 -177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 15' ' ' VAL . 42.6 t -80.66 109.41 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -176.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 55.8 mt-10 -97.14 155.42 16.83 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.603 0.716 . . . . 0.0 110.864 -176.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.473 ' HB3' HD12 ' A' ' 10' ' ' ILE . 75.2 m-85 -134.65 109.81 8.88 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.102 177.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.15 87.73 0.11 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 63.1 t -74.24 118.75 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.567 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 22.6 tptm -80.19 124.84 29.15 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 36.9 m95 -103.89 134.89 46.43 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.09 -38.79 66.27 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -165.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.36 14.68 60.43 Favored Glycine 0 N--CA 1.474 1.172 0 CA-C-N 116.365 -0.38 . . . . 0.0 113.535 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 69.2 m95 -135.47 135.67 22.7 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 123.658 0.783 . . . . 0.0 110.003 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.99 164.75 21.05 Favored 'Trans proline' 0 CA--C 1.569 2.229 0 C-N-CA 122.971 2.447 . . . . 0.0 112.402 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.91 -13.47 27.32 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 123.793 2.996 . . . . 0.0 114.754 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.8 -23.62 63.36 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.696 0.399 . . . . 0.0 111.866 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -103.58 3.08 34.21 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.727 0.811 . . . . 0.0 112.294 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.4 p -71.21 129.62 39.37 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 169.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 p -118.75 128.27 54.33 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.094 0.558 . . . . 0.0 112.228 -165.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -71.18 101.52 2.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.517 0.727 . . . . 0.0 109.324 173.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -133.31 134.91 24.55 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.502 0.721 . . . . 0.0 109.059 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 68.7 Cg_endo -68.91 167.39 23.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.839 2.359 . . . . 0.0 113.831 -173.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.08 -21.85 0.8 Allowed 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 125.329 1.451 . . . . 0.0 114.59 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -54.73 -44.72 73.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.591 1.156 . . . . 0.0 111.53 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -83.11 -5.64 59.19 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.224 -172.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.543 HG21 HG23 ' A' ' 48' ' ' VAL . 28.5 mm -80.28 121.19 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.625 HD11 ' HG3' ' B' ' 8' ' ' ARG . 5.5 mp -88.09 -47.98 8.08 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.044 0.538 . . . . 0.0 109.606 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -100.51 130.83 24.82 Favored Pre-proline 0 CA--C 1.549 0.928 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.581 -169.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.33 -35.29 24.45 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 122.699 2.266 . . . . 0.0 113.183 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.582 ' HB2' HE21 ' B' ' 5' ' ' GLN . 56.5 mmm-85 -69.42 -16.15 63.44 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.179 0.592 . . . . 0.0 111.351 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.53 -47.05 80.26 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.238 0.615 . . . . 0.0 110.461 173.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 42' ' ' ILE . 67.5 t -73.58 -44.31 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.583 0.753 . . . . 0.0 110.577 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -67.1 -55.46 14.17 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.008 -171.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.26 -28.36 67.99 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.496 0.718 . . . . 0.0 112.558 -174.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -55.3 -49.92 70.9 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.915 0.886 . . . . 0.0 111.06 171.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 123.748 0.819 . . . . 0.0 111.605 -176.57 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.582 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.9 mp0 . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.1 m -140.51 155.17 46.73 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 122.927 0.491 . . . . 0.0 110.122 -171.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.73 133.78 22.7 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.324 0.649 . . . . 0.0 111.365 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.625 ' HG3' HD11 ' A' ' 43' ' ' LEU . 94.7 mtt180 . . . . . 0 N--CA 1.489 1.498 0 C-N-CA 123.844 0.858 . . . . 0.0 110.125 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 . . . . . 0 N--CA 1.471 0.575 0 CA-C-O 121.336 0.589 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.463 HG11 HH11 ' B' ' 8' ' ' ARG . 35.2 m -97.06 127.58 49.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.963 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -130.15 148.53 52.0 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 124.088 0.955 . . . . 0.0 108.509 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.85 117.72 9.35 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.022 0.529 . . . . 0.0 109.627 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.447 HG12 ' CE3' ' A' ' 26' ' ' TRP . 11.2 m -99.64 150.79 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 123.171 0.588 . . . . 0.0 110.267 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.575 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 40.0 tt0 -73.62 -72.38 0.27 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -162.07 -176.42 5.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.141 1.377 . . . . 0.0 108.114 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.7 mm -71.3 124.49 27.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.492 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -76.97 -57.21 3.98 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.2 mttm -134.55 160.29 38.51 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.063 0.945 . . . . 0.0 110.421 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -145.61 134.49 22.47 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.91 0.884 . . . . 0.0 109.103 -166.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -167.24 176.58 6.66 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.213 0.605 . . . . 0.0 110.602 -178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -128.47 117.15 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -112.11 101.68 9.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.766 0.826 . . . . 0.0 109.299 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.5 tptp 52.99 53.12 12.54 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.61 1.164 . . . . 0.0 112.229 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.67 -17.06 58.68 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-N 115.324 -0.853 . . . . 0.0 114.066 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -91.82 118.75 30.99 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 174.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 98.3 t -83.49 102.49 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -105.93 138.59 41.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.979 0.512 . . . . 0.0 110.514 -167.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.479 ' HB3' HD12 ' A' ' 10' ' ' ILE . 22.2 m-85 -126.14 113.22 16.76 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.725 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.6 tp -64.62 100.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.975 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 164.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.48 HG21 ' CE1' ' A' ' 41' ' ' HIS . 95.3 t -100.69 129.22 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.27 109.89 19.82 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.125 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.447 ' CE3' HG12 ' A' ' 7' ' ' VAL . 27.1 m95 -83.64 106.79 15.64 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.575 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 63.4 pttt -69.26 -22.43 63.84 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -168.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.78 -36.89 92.83 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.561 0.538 . . . . 0.0 112.389 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -101.65 164.53 15.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.454 1.102 . . . . 0.0 109.48 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.69 152.64 64.68 Favored 'Trans proline' 0 CA--C 1.564 2.006 0 C-N-CA 121.612 1.541 . . . . 0.0 111.351 173.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -59.17 -8.82 7.01 Favored 'Trans proline' 0 C--N 1.388 2.639 0 C-N-CA 124.089 3.193 . . . . 0.0 115.775 -173.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -70.2 -12.72 61.79 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.05 0.386 . . . . 0.0 111.579 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -105.46 18.22 22.59 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.096 0.959 . . . . 0.0 111.286 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -68.76 116.98 9.88 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -109.81 140.48 43.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.293 0.637 . . . . 0.0 111.114 -174.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -75.46 87.33 2.61 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -102.59 127.94 29.2 Favored Pre-proline 0 CA--C 1.551 1.017 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.255 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 57.3 Cg_endo -66.66 159.31 51.68 Favored 'Trans proline' 0 C--N 1.383 2.343 0 C-N-CA 123.235 2.623 . . . . 0.0 112.545 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -58.95 -11.95 3.97 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -167.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.18 -33.57 69.39 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.307 1.043 . . . . 0.0 110.696 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.557 ' ND1' ' HB1' ' B' ' 7' ' ' ALA . 0.3 OUTLIER -79.76 -13.51 59.39 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -174.348 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mm -72.46 122.1 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.914 0.886 . . . . 0.0 110.515 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.7 mt -106.1 -0.92 24.34 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.773 0.429 . . . . 0.0 111.643 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -145.43 128.0 8.1 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 109.427 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -62.66 -43.72 20.18 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.627 2.218 . . . . 0.0 112.527 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.532 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 58.7 mtt180 -70.41 -15.48 62.84 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.833 0.853 . . . . 0.0 111.648 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.0 tp -53.63 -46.03 70.35 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.326 0.65 . . . . 0.0 110.213 168.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.82 -39.44 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 124.044 0.938 . . . . 0.0 111.317 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.532 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 20.2 mmt -71.68 -45.06 63.08 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.684 0.794 . . . . 0.0 111.874 -171.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.92 -26.91 65.33 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.506 0.722 . . . . 0.0 111.867 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -54.56 -44.2 72.7 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.123 0.569 . . . . 0.0 110.883 174.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 . . . . . 0 N--CA 1.476 0.856 0 C-N-CA 122.841 0.456 . . . . 0.0 111.671 -178.586 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.436 ' O ' HG22 ' A' ' 7' ' ' VAL . 19.4 mp0 . . . . . 0 C--O 1.239 0.548 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 m -121.61 150.09 42.21 Favored 'General case' 0 C--O 1.249 1.051 0 C-N-CA 123.832 0.853 . . . . 0.0 109.425 -174.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.557 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -156.34 147.0 21.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.279 0.632 . . . . 0.0 111.136 -175.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.463 HH11 HG11 ' A' ' 4' ' ' VAL . 2.2 mpt_? . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.478 0.711 . . . . 0.0 110.127 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.18 119.53 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -118.66 157.31 27.68 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.675 0.79 . . . . 0.0 109.625 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.51 123.86 21.99 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.054 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.598 HG21 HD13 ' A' ' 47' ' ' LEU . 12.4 m -97.1 153.28 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 123.696 0.798 . . . . 0.0 111.097 -173.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -81.95 -78.5 0.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 163.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.6 m -161.22 -173.75 4.0 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.997 1.319 . . . . 0.0 107.759 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.766 HD12 ' HB3' ' A' ' 22' ' ' TYR . 43.0 mm -81.09 115.72 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 169.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -57.68 6.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.123 0.969 . . . . 0.0 109.382 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.5 mttm -136.44 162.45 33.02 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.154 0.982 . . . . 0.0 110.008 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -146.58 141.09 26.6 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.706 0.803 . . . . 0.0 108.89 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -162.89 -176.57 4.99 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.687 1.195 . . . . 0.0 108.966 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 23.9 t -128.21 144.95 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -147.16 116.95 7.15 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt 65.73 28.74 10.95 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.563 1.145 . . . . 0.0 110.747 175.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.1 -12.97 58.76 Favored Glycine 0 C--N 1.352 1.455 0 CA-C-N 115.485 -0.779 . . . . 0.0 113.011 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -95.79 112.37 24.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.284 0.634 . . . . 0.0 109.639 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.0 t -70.41 119.95 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.451 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -94.0 142.35 27.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.514 0.725 . . . . 0.0 109.658 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.766 ' HB3' HD12 ' A' ' 10' ' ' ILE . 97.7 m-85 -130.4 108.08 9.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.284 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.431 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 44.1 tp -65.96 84.51 0.08 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.03 109.54 2.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -77.62 124.97 28.62 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 172.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m95 -97.84 136.53 38.03 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 28' ' ' GLY . 0.1 OUTLIER -65.25 -31.12 72.11 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -168.032 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.51 ' N ' ' HD3' ' A' ' 27' ' ' LYS . . . -97.78 2.56 60.33 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.946 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 33' ' ' TYR . 60.4 m95 -124.58 133.36 24.69 Favored Pre-proline 0 N--CA 1.471 0.61 0 C-N-CA 123.576 0.75 . . . . 0.0 109.647 -172.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.12 165.18 12.94 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.028 2.485 . . . . 0.0 112.277 174.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -57.53 -23.36 56.01 Favored 'Trans proline' 0 C--N 1.39 2.745 0 C-N-CA 123.254 2.636 . . . . 0.0 114.154 -176.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -13.33 61.35 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.13 0.572 . . . . 0.0 112.495 177.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 81.9 m-85 -113.86 1.39 14.76 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.585 0.754 . . . . 0.0 112.306 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.9 p -69.14 130.29 42.27 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 171.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.2 p -117.78 138.57 51.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.084 0.554 . . . . 0.0 111.404 -169.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -72.87 84.66 1.23 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.638 0.775 . . . . 0.0 109.087 176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -96.95 116.33 66.03 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.445 0.698 . . . . 0.0 109.131 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.72 176.2 4.55 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.464 2.109 . . . . 0.0 113.882 -175.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -50.41 -36.31 32.36 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.96 1.704 . . . . 0.0 113.212 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -60.84 -34.88 75.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.404 1.082 . . . . 0.0 112.382 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -83.37 -23.64 32.35 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.354 0.662 . . . . 0.0 112.258 -173.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.586 HG21 HG23 ' A' ' 48' ' ' VAL . 27.0 mm -71.93 108.45 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HB ' ' B' ' 6' ' ' THR . 4.6 pp -99.46 -24.5 14.76 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 117.667 0.212 . . . . 0.0 111.505 -173.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -104.11 120.54 50.64 Favored Pre-proline 0 N--CA 1.475 0.801 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -64.83 -20.12 64.53 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.3 2.0 . . . . 0.0 111.583 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -61.19 -20.51 62.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.835 1.254 . . . . 0.0 112.222 177.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.598 HD13 HG21 ' A' ' 7' ' ' VAL . 16.7 tp -71.72 -47.49 53.54 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.056 0.542 . . . . 0.0 111.164 178.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.586 HG23 HG21 ' A' ' 42' ' ' ILE . 78.8 t -77.67 -37.72 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.346 0.658 . . . . 0.0 110.682 179.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.6 mmt -67.08 -41.06 87.01 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.14 -178.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.91 70.31 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.278 0.561 . . . . 0.0 111.493 178.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -71.8 -53.24 13.97 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.231 1.013 . . . . 0.0 110.937 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 N--CA 1.482 1.151 0 C-N-CA 122.795 0.438 . . . . 0.0 111.236 -173.635 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.508 HE21 ' HA ' ' A' ' 47' ' ' LEU . 49.0 tt0 . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.592 ' HB ' HD11 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -147.85 152.6 37.9 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.434 0.635 . . . . 0.0 111.692 -172.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.88 160.62 37.11 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.392 1.077 . . . . 0.0 109.494 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 . . . . . 0 C--O 1.238 0.466 0 C-N-CA 124.246 1.019 . . . . 0.0 109.198 175.781 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -96.79 140.88 16.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -130.26 142.03 50.58 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.264 0.626 . . . . 0.0 109.461 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 126.91 30.68 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.729 169.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.99 154.66 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.022 0.439 . . . . 0.0 111.565 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 42.9 tt0 -78.33 -63.57 1.37 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.946 172.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.6 m -165.56 173.39 10.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.681 1.192 . . . . 0.0 110.073 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.457 HD12 ' HB3' ' A' ' 22' ' ' TYR . 41.3 mm -85.11 126.59 40.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 162.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -52.79 6.26 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.99 170.04 16.7 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.829 0.852 . . . . 0.0 110.17 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -156.61 145.63 20.29 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.131 0.573 . . . . 0.0 110.094 -173.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -159.93 169.88 22.55 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.896 0.878 . . . . 0.0 109.208 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.41 115.91 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 166.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -137.0 126.45 25.04 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -174.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 65.46 24.95 11.91 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.016 0.913 . . . . 0.0 110.374 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.89 -9.05 47.31 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.282 -0.872 . . . . 0.0 113.18 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -93.92 111.43 23.14 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 123.988 0.915 . . . . 0.0 108.918 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.403 ' HB ' ' HG3' ' A' ' 39' ' ' GLU . 23.6 t -77.17 106.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -98.4 138.6 35.4 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 123.96 0.904 . . . . 0.0 110.288 -173.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 59.0 m-85 -122.61 117.25 25.39 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 tp -71.07 81.77 0.69 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.552 HG21 ' NE2' ' A' ' 41' ' ' HIS . 85.6 t -75.88 110.35 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.009 -169.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -75.39 107.44 7.51 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 52.7 m95 -75.78 147.83 38.93 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.093 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.6 OUTLIER -64.46 -54.49 31.79 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.164 0.586 . . . . 0.0 112.146 -169.192 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.81 13.19 64.0 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 116.207 -0.451 . . . . 0.0 113.796 -175.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 70.5 m95 -117.78 141.43 29.08 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 123.526 0.73 . . . . 0.0 109.772 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 41.3 Cg_endo -64.59 160.83 38.06 Favored 'Trans proline' 0 CA--C 1.563 1.932 0 C-N-CA 122.904 2.403 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.16 -20.37 46.13 Favored 'Trans proline' 0 C--N 1.389 2.659 0 C-N-CA 123.604 2.869 . . . . 0.0 115.184 -177.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -74.22 -19.81 60.39 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.412 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 39.3 m-85 -96.22 5.72 50.4 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.793 0.837 . . . . 0.0 111.897 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.9 p -68.36 117.85 10.68 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.7 p -106.06 144.29 32.99 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.503 0.721 . . . . 0.0 110.797 -173.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.04 80.03 1.71 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.051 0.929 . . . . 0.0 109.889 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -83.82 120.79 75.59 Favored Pre-proline 0 C--O 1.242 0.682 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.953 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.35 155.63 69.04 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 121.933 1.755 . . . . 0.0 111.428 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.403 ' HG3' ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -49.89 -19.89 0.78 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.686 1.595 . . . . 0.0 114.849 -177.332 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -55.35 -32.72 62.78 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.461 1.104 . . . . 0.0 112.854 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.604 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.8 p-80 -82.07 -12.22 58.37 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.89 120.63 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.935 0.894 . . . . 0.0 110.335 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.465 HD12 HG22 ' B' ' 6' ' ' THR . 38.0 mt -110.02 2.23 19.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.756 0.423 . . . . 0.0 110.985 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -150.89 127.19 5.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.328 0.651 . . . . 0.0 110.622 -174.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.32 -37.33 40.74 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.943 2.428 . . . . 0.0 112.199 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -64.81 -18.49 65.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.452 0.701 . . . . 0.0 111.478 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.87 -52.59 48.98 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.224 0.61 . . . . 0.0 111.314 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.05 -37.64 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-O 121.567 0.699 . . . . 0.0 110.075 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.6 mmt -70.98 -29.24 65.15 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.847 -178.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -30.56 70.76 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.007 0.432 . . . . 0.0 110.692 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -76.07 -56.29 4.79 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.543 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 . . . . . 0 N--CA 1.481 1.113 0 C-N-CA 123.079 0.551 . . . . 0.0 110.934 -171.621 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.835 0 CA-C-O 121.802 0.811 . . . . 0.0 109.265 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.465 HG22 HD12 ' A' ' 43' ' ' LEU . 13.0 m -117.87 150.99 38.27 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.913 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.604 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -151.56 129.53 11.77 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.976 -175.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 . . . . . 0 N--CA 1.478 0.941 0 C-N-CA 123.838 0.855 . . . . 0.0 110.792 172.545 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.44 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 1.8 mp0 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -105.35 130.37 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.44 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 37.3 m-85 -130.18 164.05 25.32 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.545 0.738 . . . . 0.0 109.747 179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.35 115.05 5.87 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.601 HG21 HD13 ' A' ' 47' ' ' LEU . 14.2 m -79.94 156.06 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 123.085 0.554 . . . . 0.0 110.242 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.586 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 37.1 tt0 -85.75 -67.93 0.77 Allowed 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 161.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 m -164.99 -167.79 1.29 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.157 1.383 . . . . 0.0 108.142 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.477 HD12 ' HB3' ' A' ' 22' ' ' TYR . 46.4 mm -91.93 133.2 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 163.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -88.22 -54.8 4.03 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.444 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 97.7 mttt -136.83 176.87 8.32 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.718 0.807 . . . . 0.0 110.583 -178.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -153.62 144.7 22.88 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -160.18 -175.04 4.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.923 0.889 . . . . 0.0 109.272 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.9 p -142.81 132.5 22.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 173.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -134.27 105.4 6.61 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.134 0.974 . . . . 0.0 109.101 -172.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.6 39.52 29.79 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.79 1.236 . . . . 0.0 111.566 -178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.92 -18.27 56.26 Favored Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.811 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -87.13 110.57 20.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 117.077 0.438 . . . . 0.0 110.764 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -75.06 110.15 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.603 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 34.8 mt-10 -101.11 146.69 27.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.472 0.709 . . . . 0.0 110.538 -173.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.9 m-85 -127.16 119.25 26.02 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.444 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 35.3 tp -70.46 82.84 0.58 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.97 107.19 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -176.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -77.58 118.94 20.47 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 40.1 m95 -92.61 149.43 21.35 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.586 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 3.5 tppp? -61.13 -51.61 68.35 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.189 0.996 . . . . 0.0 112.991 -167.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.93 6.53 76.63 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.61 -0.328 . . . . 0.0 113.576 -177.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 36.1 m95 -121.46 132.52 24.2 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.806 0.843 . . . . 0.0 109.632 -169.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 47.3 Cg_endo -66.03 165.96 22.32 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.974 2.449 . . . . 0.0 112.78 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.0 0.44 2.57 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 123.46 2.773 . . . . 0.0 115.207 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -91.88 -31.61 15.62 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 118.233 0.469 . . . . 0.0 111.077 168.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.448 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 49.4 m-85 -86.08 -1.75 57.68 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.461 0.705 . . . . 0.0 111.343 175.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.1 p -70.9 141.09 51.18 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 168.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.68 141.54 51.58 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.818 0.447 . . . . 0.0 111.935 -170.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -76.35 85.29 3.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.202 1.001 . . . . 0.0 110.282 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -95.22 114.63 64.2 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.513 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 71.9 Cg_exo -53.63 172.35 0.25 Allowed 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 123.653 2.902 . . . . 0.0 114.845 176.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.26 66.29 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.857 -176.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -70.72 -29.27 65.5 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.897 0.479 . . . . 0.0 111.352 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -77.22 -33.03 56.25 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.231 0.612 . . . . 0.0 110.624 177.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 36.0 mm -71.79 116.9 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.1 15.39 23.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.565 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -134.37 127.97 19.07 Favored Pre-proline 0 N--CA 1.476 0.829 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.24 -56.53 1.54 Allowed 'Trans proline' 0 C--N 1.378 2.094 0 C-N-CA 122.594 2.196 . . . . 0.0 112.183 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.514 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 84.6 mtt85 -69.54 -15.27 63.2 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.75 0.82 . . . . 0.0 112.993 -170.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 23.8 tp -56.94 -44.36 82.45 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-O 121.121 0.486 . . . . 0.0 110.126 169.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.563 HG23 HG21 ' A' ' 42' ' ' ILE . 53.8 t -84.25 -48.85 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.469 1.107 . . . . 0.0 111.122 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.514 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.7 mmt -62.41 -37.97 87.86 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.214 -170.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.94 -45.43 85.81 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.818 0.447 . . . . 0.0 111.137 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -54.41 -50.73 66.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.088 0.955 . . . . 0.0 111.445 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.149 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.9 p -141.85 159.61 41.87 Favored 'General case' 0 C--O 1.256 1.445 0 C-N-CA 123.902 0.881 . . . . 0.0 110.258 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.56 141.79 30.83 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.432 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 . . . . . 0 N--CA 1.471 0.578 0 C-N-CA 123.399 0.68 . . . . 0.0 109.406 179.03 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.468 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.4 m -131.1 98.41 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.754 1.222 . . . . 0.0 109.426 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.16 156.29 22.54 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.133 0.573 . . . . 0.0 111.372 -172.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.25 139.67 38.89 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.018 169.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.4 HG12 ' CE3' ' A' ' 26' ' ' TRP . 10.1 m -120.23 157.11 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.68 0.792 . . . . 0.0 110.646 -171.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 5.9 tp10 -61.5 -65.21 0.73 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 164.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.01 -179.52 4.69 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.479 1.112 . . . . 0.0 109.412 -179.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.8 mm -75.19 106.33 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 161.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.546 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -63.07 -54.01 44.65 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.366 0.667 . . . . 0.0 110.191 -178.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -138.62 172.96 12.11 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.408 0.683 . . . . 0.0 110.389 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -153.39 127.17 8.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.852 0.861 . . . . 0.0 108.779 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.87 178.43 9.16 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.357 0.663 . . . . 0.0 110.373 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.62 116.05 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.759 0.824 . . . . 0.0 108.962 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -131.53 121.65 24.81 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.6 tptt 65.62 26.41 11.57 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.518 1.127 . . . . 0.0 110.672 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.66 -13.39 58.7 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.821 -176.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -86.95 110.55 20.1 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.261 0.625 . . . . 0.0 109.483 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.9 t -77.79 107.24 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -104.05 136.14 44.25 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.901 0.481 . . . . 0.0 110.275 -172.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -113.92 121.06 42.79 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.546 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.9 tp -71.36 113.93 8.91 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG21 ' CE1' ' A' ' 41' ' ' HIS . 13.1 t -100.5 108.14 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -170.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -77.3 110.39 11.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.238 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 34' ' ' SER . 38.8 m95 -87.18 133.31 33.66 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 8' ' ' GLU . 2.9 tppp? -80.34 -50.08 10.65 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.346 0.658 . . . . 0.0 111.543 -172.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.75 -4.19 87.84 Favored Glycine 0 CA--C 1.54 1.65 0 N-CA-C 114.03 0.372 . . . . 0.0 114.03 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.5 m95 -120.28 149.43 49.53 Favored Pre-proline 0 N--CA 1.48 1.036 0 C-N-CA 124.247 1.019 . . . . 0.0 109.956 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.06 150.97 87.25 Favored 'Trans proline' 0 C--N 1.382 2.298 0 C-N-CA 122.685 2.257 . . . . 0.0 112.601 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -54.75 -30.39 66.87 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 124.507 3.472 . . . . 0.0 116.013 -167.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -73.02 -17.02 61.48 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -78.97 -1.36 34.98 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.909 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 57.0 m -67.12 116.51 8.0 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 174.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 p -97.97 141.24 31.18 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.138 0.975 . . . . 0.0 111.139 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -78.96 105.6 10.4 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 167.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.427 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 13.1 mm-40 -121.34 126.99 26.33 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.236 1.014 . . . . 0.0 109.402 -173.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -57.26 142.43 94.71 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 123.565 2.843 . . . . 0.0 111.87 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -54.4 -24.36 19.45 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -164.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.88 -24.81 67.99 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 124.265 1.026 . . . . 0.0 112.003 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.44 ' CE1' HG21 ' A' ' 24' ' ' VAL . 2.7 p80 -70.43 -19.49 62.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.458 0.703 . . . . 0.0 112.457 -174.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.605 HG23 HD23 ' A' ' 47' ' ' LEU . 36.8 mm -71.44 134.08 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.334 0.654 . . . . 0.0 109.432 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.496 HD12 ' HB ' ' B' ' 6' ' ' THR . 31.7 mt -100.15 5.12 44.81 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.154 0.582 . . . . 0.0 111.534 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 42' ' ' ILE . 32.5 t70 -151.13 125.34 4.48 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 122.757 0.423 . . . . 0.0 111.379 -174.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -64.55 -37.05 39.77 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.526 2.151 . . . . 0.0 112.699 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.448 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 88.8 mtt-85 -68.27 -15.12 63.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.487 0.715 . . . . 0.0 111.989 -175.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.605 HD23 HG23 ' A' ' 42' ' ' ILE . 12.0 tp -69.06 -52.51 27.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.384 0.674 . . . . 0.0 110.598 173.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.18 -33.43 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 121.594 0.711 . . . . 0.0 109.609 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.448 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 97.7 mmm -73.74 -29.38 62.2 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.971 176.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.3 -29.68 69.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.563 0.345 . . . . 0.0 110.347 174.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -71.7 -57.72 4.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.39 0.676 . . . . 0.0 110.709 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 . . . . . 0 N--CA 1.478 0.958 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.31 -168.694 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.7 mm100 . . . . . 0 N--CA 1.471 0.596 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.496 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.4 p -74.66 128.74 36.29 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.475 0.71 . . . . 0.0 111.119 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.45 134.85 36.29 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.468 ' HG2' HG12 ' A' ' 4' ' ' VAL . 97.0 mtt180 . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 121.822 0.82 . . . . 0.0 112.503 -177.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 . . . . . 0 CA--C 1.543 0.681 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.7 m -111.49 148.2 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.043 0.937 . . . . 0.0 110.58 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -146.78 164.07 33.97 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.816 0.847 . . . . 0.0 111.258 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.68 126.01 28.59 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.071 173.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 47' ' ' LEU . 35.8 m -104.95 151.45 7.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 124.051 0.94 . . . . 0.0 111.025 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -86.17 -70.52 0.59 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 168.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.8 m -162.4 -177.63 5.78 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 125.176 1.39 . . . . 0.0 108.544 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.6 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.1 mm -76.5 119.84 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 168.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.11 -50.89 36.14 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -142.67 158.15 43.95 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.78 0.832 . . . . 0.0 110.565 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -142.76 125.46 15.93 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.303 0.641 . . . . 0.0 109.824 -169.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -154.52 175.22 13.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.568 0.747 . . . . 0.0 109.546 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 11.5 p -118.31 142.94 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 171.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.455 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -150.57 120.87 7.31 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.805 0.842 . . . . 0.0 108.983 -176.264 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.455 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 27.7 mtpp 60.98 29.45 19.02 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.396 1.078 . . . . 0.0 111.747 178.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.3 -13.44 65.12 Favored Glycine 0 C--N 1.353 1.51 0 CA-C-N 116.091 -0.504 . . . . 0.0 113.457 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -103.72 117.6 34.77 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.729 0.811 . . . . 0.0 110.092 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 53.0 t -69.33 110.14 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.62 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 69.5 mt-10 -98.7 144.51 27.89 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.203 1.001 . . . . 0.0 110.477 -176.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.6 ' HB3' HD12 ' A' ' 10' ' ' ILE . 74.5 m-85 -126.78 116.95 21.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.726 -1.124 . . . . 0.0 108.573 -174.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.58 102.2 0.88 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 166.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -87.65 117.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -81.65 113.38 19.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 172.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -84.26 125.28 32.09 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -61.19 -43.1 99.42 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.482 0.713 . . . . 0.0 112.048 -169.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.78 4.55 83.54 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-O 119.609 -0.551 . . . . 0.0 114.177 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 39.0 m95 -120.99 143.12 36.11 Favored Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 123.499 0.72 . . . . 0.0 110.177 -178.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.37 152.13 82.71 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.93 2.42 . . . . 0.0 111.914 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.75 -34.1 5.46 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 124.893 3.729 . . . . 0.0 117.108 -171.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -69.98 -17.37 63.29 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.812 0.733 . . . . 0.0 112.816 -173.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -88.54 4.97 44.89 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.854 0.462 . . . . 0.0 111.713 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -64.15 124.25 21.18 Favored 'General case' 0 C--N 1.351 0.655 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.0 p -112.13 127.3 55.89 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.291 0.636 . . . . 0.0 112.009 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -75.88 78.91 2.78 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.789 0.835 . . . . 0.0 109.919 175.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -104.47 143.69 27.2 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.62 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 92.4 Cg_endo -77.97 176.72 9.66 Favored 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 122.264 1.976 . . . . 0.0 113.474 -172.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -48.21 -22.45 0.66 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.887 1.675 . . . . 0.0 113.816 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -56.61 -31.01 63.88 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.69 1.596 . . . . 0.0 113.289 175.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HD2' ' HB1' ' B' ' 7' ' ' ALA . 9.4 p-80 -87.13 -8.83 56.59 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.225 0.61 . . . . 0.0 112.359 -168.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 26.4 mm -80.18 122.69 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.124 0.569 . . . . 0.0 110.956 -171.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.578 HD11 ' HG3' ' B' ' 8' ' ' ARG . 6.8 mp -96.29 -15.97 21.63 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 177.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -150.94 130.46 6.6 Favored Pre-proline 0 N--CA 1.473 0.677 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -176.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.63 -25.35 54.56 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 123.162 2.575 . . . . 0.0 113.692 -173.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.12 -19.53 61.61 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.004 0.522 . . . . 0.0 111.546 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.478 HD13 HG21 ' A' ' 7' ' ' VAL . 10.7 tp -60.29 -47.21 87.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.881 0.472 . . . . 0.0 110.994 176.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.37 -46.65 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.512 0.725 . . . . 0.0 110.448 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -62.46 -54.26 42.71 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.762 -175.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.23 70.04 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.13 0.423 . . . . 0.0 111.692 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.17 -56.92 15.59 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.898 0.479 . . . . 0.0 109.955 172.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 123.178 0.591 . . . . 0.0 111.044 179.456 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 120.722 0.296 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 10.9 m 70.05 138.59 0.04 OUTLIER 'General case' 0 C--O 1.253 1.287 0 C-N-CA 124.604 1.162 . . . . 0.0 112.231 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.635 ' HB1' ' HD2' ' A' ' 41' ' ' HIS . . . -146.37 135.39 22.57 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.334 -175.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG3' HD11 ' A' ' 43' ' ' LEU . 44.7 mtp180 . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 166.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 112.05 -0.42 . . . . 0.0 112.05 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -91.93 150.79 20.84 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.016 0.527 . . . . 0.0 110.496 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -79.75 95.03 5.87 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.382 0.673 . . . . 0.0 110.252 -176.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.6 m -124.77 142.51 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.651 0.78 . . . . 0.0 110.614 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -135.41 163.21 30.55 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.285 1.034 . . . . 0.0 109.173 176.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.03 105.72 3.43 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.4 0.68 . . . . 0.0 109.376 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.498 HG12 ' CZ3' ' A' ' 26' ' ' TRP . 1.6 m -87.56 154.13 3.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.906 -176.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -82.08 -79.99 0.17 Allowed 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.0 m -160.21 -174.04 4.33 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.517 1.127 . . . . 0.0 108.804 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.558 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.4 mm -80.88 134.72 26.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 172.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -91.03 -53.73 4.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.902 0.881 . . . . 0.0 109.571 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -133.43 153.72 51.37 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.979 0.911 . . . . 0.0 109.306 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -135.73 135.32 39.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.7 ptm85 -162.47 173.36 14.15 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.606 0.762 . . . . 0.0 110.106 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 20' ' ' VAL . 14.4 t -119.34 119.9 62.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 175.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -118.93 110.75 17.52 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.985 0.914 . . . . 0.0 110.059 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp 60.55 31.5 20.26 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 124.287 1.035 . . . . 0.0 111.832 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.48 10.04 62.42 Favored Glycine 0 C--N 1.352 1.467 0 CA-C-N 115.195 -0.911 . . . . 0.0 113.377 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -124.64 111.82 16.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.956 0.903 . . . . 0.0 109.98 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.445 HG22 HG22 ' A' ' 15' ' ' VAL . 38.4 t -70.62 108.15 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.666 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 18.9 pt-20 -107.57 151.26 25.85 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.796 0.808 . . . . 0.0 110.696 -176.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.558 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -130.71 125.88 35.06 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.315 -1.311 . . . . 0.0 108.33 -173.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.8 tp -73.89 83.2 1.69 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 98.1 t -68.59 111.08 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -76.74 117.56 18.48 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.498 ' CZ3' HG12 ' A' ' 7' ' ' VAL . 26.6 m95 -90.46 121.1 32.12 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 176.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -70.43 -37.75 74.45 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -161.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.04 -10.99 84.21 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 116.523 -0.308 . . . . 0.0 113.268 177.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.409 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.8 m95 -108.43 148.99 38.75 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 124.618 1.167 . . . . 0.0 109.165 -177.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.41 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 56.9 Cg_endo -66.9 159.65 50.68 Favored 'Trans proline' 0 CA--C 1.559 1.742 0 C-N-CA 122.092 1.861 . . . . 0.0 111.141 177.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.93 -16.22 48.15 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 122.966 2.444 . . . . 0.0 113.449 -176.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -31.22 65.61 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.169 0.588 . . . . 0.0 111.694 173.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.41 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 29.2 m-85 -88.65 9.74 23.12 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.526 0.73 . . . . 0.0 111.802 177.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.7 m -75.33 132.39 40.94 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.7 p -121.4 168.25 11.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.621 0.768 . . . . 0.0 111.059 -172.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -97.39 95.18 7.5 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.253 0.621 . . . . 0.0 110.997 -175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -96.96 122.88 55.31 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 123.645 0.778 . . . . 0.0 109.327 175.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 59.4 Cg_endo -69.03 171.24 14.0 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.085 1.857 . . . . 0.0 112.291 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -27.17 44.66 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.143 0.977 . . . . 0.0 111.774 174.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -57.87 -34.9 70.25 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.47 1.508 . . . . 0.0 111.293 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -98.64 -19.76 17.36 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.187 0.995 . . . . 0.0 111.511 -176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.672 HG23 HD23 ' A' ' 47' ' ' LEU . 51.2 mm -71.35 114.42 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 123.024 0.53 . . . . 0.0 109.974 178.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.424 HD21 ' HD3' ' B' ' 8' ' ' ARG . 31.1 mt -83.65 -50.49 8.14 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.552 0.691 . . . . 0.0 110.14 -177.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -93.39 133.14 28.83 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.525 -166.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.26 -38.62 8.63 Favored 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.625 2.217 . . . . 0.0 112.201 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.503 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 47.6 mtm180 -69.82 -17.18 63.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.316 1.046 . . . . 0.0 111.119 -176.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.672 HD23 HG23 ' A' ' 42' ' ' ILE . 19.6 tp -59.21 -48.73 80.53 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 123.901 0.88 . . . . 0.0 111.142 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 80.7 t -84.46 -38.73 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.509 0.724 . . . . 0.0 110.675 179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.503 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 57.7 mtt -64.94 -32.12 73.69 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.348 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.0 -46.94 82.31 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.88 0.472 . . . . 0.0 109.862 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -58.84 -38.19 78.13 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.495 1.118 . . . . 0.0 111.718 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -97.98 -5.75 33.52 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 70.83 19.41 5.86 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 124.873 1.269 . . . . 0.0 112.739 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.49 6.44 37.73 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.761 0.824 . . . . 0.0 111.202 172.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -69.06 -26.2 64.84 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 168.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 C--O 1.251 1.151 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.007 170.944 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -97.43 104.79 16.84 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 7.8 t -104.27 137.53 42.04 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -73.85 114.98 12.76 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.475 ' O ' HG22 ' A' ' 7' ' ' VAL . 4.8 pm0 -54.13 143.49 22.33 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 124.359 1.037 . . . . 0.0 110.107 168.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 23.8 m -146.99 153.25 39.84 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.105 0.478 . . . . 0.0 111.903 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.07 148.6 42.0 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.863 1.265 . . . . 0.0 108.858 171.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.424 ' HD3' HD21 ' A' ' 43' ' ' LEU . 2.8 mpt_? -82.31 134.23 35.26 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 170.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.441 ' HG3' ' CZ2' ' A' ' 26' ' ' TRP . . . . . . . . 0 N--CA 1.475 0.822 0 CA-C-N 118.16 0.437 . . . . 0.0 111.981 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 17.6 t -72.21 83.57 1.03 Allowed 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.725 0.774 . . . . 0.0 109.749 -178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 7.2 t -97.96 -7.44 30.05 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 114.42 -1.264 . . . . 0.0 110.074 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.98 -72.14 2.89 Favored Glycine 0 C--N 1.355 1.585 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.244 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 70.19 -154.32 52.52 Favored Glycine 0 C--N 1.347 1.191 0 CA-C-N 115.8 -0.2 . . . . 0.0 112.775 -178.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -84.38 116.03 22.83 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.189 0 O-C-N 123.835 0.709 . . . . 0.0 110.016 -176.453 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.477 1.399 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -105.75 -55.36 2.34 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.436 0.695 . . . . 0.0 111.238 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.6 mp0 -74.47 102.38 4.45 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.544 -170.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.7 m -99.15 126.84 52.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 123.775 0.83 . . . . 0.0 109.362 173.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 38.7 m-85 -131.0 152.74 49.99 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.297 0.639 . . . . 0.0 110.583 -177.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.15 107.72 1.65 Allowed 'General case' 0 C--O 1.246 0.898 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.311 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.402 HG21 HD13 ' A' ' 47' ' ' LEU . 20.3 m -90.85 155.88 3.05 Favored 'Isoleucine or valine' 0 C--O 1.242 0.69 0 C-N-CA 124.314 1.046 . . . . 0.0 110.742 -177.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -83.22 -74.01 0.38 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 161.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.6 m -161.4 -177.57 6.07 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.325 1.05 . . . . 0.0 109.628 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.6 mm -76.33 114.49 16.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 172.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.0 -51.48 38.85 Favored 'General case' 0 CA--C 1.56 1.337 0 C-N-CA 123.343 0.657 . . . . 0.0 109.369 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -139.28 155.82 47.48 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.792 0.837 . . . . 0.0 110.355 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -146.12 134.33 21.69 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.093 0.957 . . . . 0.0 109.071 -175.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.439 HH21 ' HB2' ' A' ' 16' ' ' ARG . 7.2 ptm180 -163.21 -174.55 3.87 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.708 1.203 . . . . 0.0 109.465 -173.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -136.66 139.73 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 123.541 0.736 . . . . 0.0 109.18 175.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' HH21 ' A' ' 14' ' ' ARG . 22.3 tpt180 -141.72 132.24 25.34 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt 59.49 26.12 15.02 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 124.599 1.16 . . . . 0.0 112.102 -178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.05 23.71 73.71 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.414 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -125.68 120.87 31.87 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.641 0.776 . . . . 0.0 109.288 173.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 28.1 t -73.88 112.96 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 123.293 0.637 . . . . 0.0 110.348 -174.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -96.86 147.87 23.51 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.493 0.717 . . . . 0.0 110.604 -175.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HB2' ' HE1' ' A' ' 41' ' ' HIS . 90.9 m-85 -132.4 112.35 12.09 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.989 0.916 . . . . 0.0 109.735 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.98 101.0 3.1 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 164.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 88.3 t -93.36 123.61 45.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-O 121.054 0.454 . . . . 0.0 110.321 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -83.98 107.76 16.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.821 172.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 9.1 m95 -83.19 119.05 24.06 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 174.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -69.17 -28.33 66.32 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.269 0.486 . . . . 0.0 111.816 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.39 -23.18 77.66 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.595 -0.275 . . . . 0.0 113.283 175.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 15.0 m95 -107.97 139.37 20.6 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.211 1.004 . . . . 0.0 109.54 -174.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -62.31 156.36 51.57 Favored 'Trans proline' 0 CA--C 1.563 1.964 0 C-N-CA 122.469 2.113 . . . . 0.0 111.86 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -50.79 -26.48 17.83 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.92 3.08 . . . . 0.0 115.427 -175.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -67.44 -14.29 62.8 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -111.27 18.55 19.18 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.984 0.914 . . . . 0.0 111.692 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 p -68.69 123.18 20.2 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.0 p -121.28 167.15 13.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.272 0.629 . . . . 0.0 111.588 -172.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -111.16 121.73 46.06 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.204 1.002 . . . . 0.0 109.394 -173.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' B' ' 9' ' ' M3L . 7.2 mp0 -129.54 146.44 61.08 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -75.76 174.79 12.22 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.127 1.885 . . . . 0.0 112.701 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 10.8 pt-20 -49.58 -28.28 5.49 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 126.308 1.843 . . . . 0.0 114.613 -174.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.76 -33.7 61.59 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.881 1.272 . . . . 0.0 112.44 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 3.4 p-80 -81.67 -18.83 43.17 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -168.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 34.7 mm -72.87 113.57 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 122.95 0.5 . . . . 0.0 109.681 -176.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -88.38 -33.56 17.88 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.98 0.419 . . . . 0.0 110.634 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.455 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 13.6 t70 -119.69 130.64 24.74 Favored Pre-proline 0 N--CA 1.48 1.043 0 C-N-CA 123.822 0.849 . . . . 0.0 110.709 -174.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -64.95 -36.08 40.48 Favored 'Trans proline' 0 C--N 1.381 2.271 0 C-N-CA 123.066 2.511 . . . . 0.0 113.008 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.457 ' HB2' HE21 ' B' ' 5' ' ' GLN . 95.0 mtt180 -65.37 -23.55 67.01 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.06 0.544 . . . . 0.0 111.05 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.402 HD13 HG21 ' A' ' 7' ' ' VAL . 34.6 tp -56.7 -52.37 65.21 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.652 0.781 . . . . 0.0 111.202 173.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.7 t -71.83 -51.86 29.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.846 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 23.1 mmt -62.09 -28.46 69.63 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.409 -1.269 . . . . 0.0 112.667 -172.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.87 -44.79 92.01 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 121.289 0.566 . . . . 0.0 111.002 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -72.11 -36.85 69.55 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.324 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -68.38 -35.31 77.52 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.441 0.296 . . . . 0.0 111.185 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.644 ' HG3' ' HD3' ' A' ' 54' ' ' LYS . 17.9 pt-20 -79.1 -37.12 39.53 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.363 0.265 . . . . 0.0 110.813 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.644 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 3.8 mppt? -89.33 -163.48 1.0 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.374 0.67 . . . . 0.0 109.268 170.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -144.22 131.71 21.0 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.916 0.486 . . . . 0.0 110.018 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 CA--C 1.559 1.295 0 C-N-CA 125.829 1.652 . . . . 0.0 112.367 176.839 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -87.17 91.1 8.6 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.271 0.629 . . . . 0.0 110.949 177.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 31.3 m 64.38 104.81 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.815 1.246 . . . . 0.0 111.868 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -160.08 81.55 0.7 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.679 0.792 . . . . 0.0 109.047 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.457 HE21 ' HB2' ' A' ' 46' ' ' ARG . 26.6 mp0 52.16 23.79 2.47 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.128 0.971 . . . . 0.0 112.629 176.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -65.47 145.04 56.62 Favored 'General case' 0 C--O 1.249 1.032 0 C-N-CA 123.695 0.798 . . . . 0.0 111.59 -172.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -137.72 116.69 12.43 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 114.174 -1.375 . . . . 0.0 109.143 -172.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 41.6 mtm180 -75.59 153.9 37.05 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.493 175.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.478 ' HA ' ' HG2' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.476 0.83 0 O-C-N 121.512 -0.743 . . . . 0.0 110.143 174.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.9 t -63.71 89.95 0.05 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.028 0.931 . . . . 0.0 111.417 -171.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 73.4 p -132.61 163.0 29.87 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.059 0.943 . . . . 0.0 110.136 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.04 -38.2 0.6 Allowed Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.874 -0.491 . . . . 0.0 111.874 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 156.62 -54.03 0.41 Allowed Glycine 0 C--N 1.339 0.717 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -139.38 146.92 40.78 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 0.0 110.219 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 166.785 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 CA-C-O 120.109 -0.273 . . . . 0.0 112.798 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -87.27 -178.34 6.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.02 0.528 . . . . 0.0 110.712 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -88.37 90.46 8.41 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 122.889 0.476 . . . . 0.0 111.31 -168.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' B' ' 8' ' ' ARG . 33.4 m -132.07 142.42 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 C-N-CA 123.683 0.793 . . . . 0.0 109.821 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.423 ' CD1' ' HE2' ' B' ' 9' ' ' M3L . 33.9 m-85 -135.53 160.29 38.93 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.044 0.938 . . . . 0.0 110.218 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -63.73 114.81 4.24 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.528 0.731 . . . . 0.0 109.927 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.6 m -80.02 153.0 4.55 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.187 0.518 . . . . 0.0 110.698 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 37.3 tt0 -94.19 -62.33 1.36 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 172.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.58 -172.79 2.0 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.528 1.531 . . . . 0.0 108.559 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 mm -91.92 139.45 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 164.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.66 -50.28 4.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.457 0.703 . . . . 0.0 109.916 -178.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -137.55 171.26 14.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.385 0.674 . . . . 0.0 110.603 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.72 134.2 15.39 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -173.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -155.67 -178.0 6.97 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.987 0.915 . . . . 0.0 110.047 -174.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.97 139.57 33.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 123.832 0.853 . . . . 0.0 108.805 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -149.83 108.97 3.92 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.134 0.973 . . . . 0.0 108.844 -170.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm 59.99 32.36 21.07 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.243 1.017 . . . . 0.0 111.242 -177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.66 -17.83 56.77 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 115.27 -0.877 . . . . 0.0 113.55 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -87.88 111.95 21.98 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.043 0.537 . . . . 0.0 110.481 -177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.8 t -79.09 110.48 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 177.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -103.61 148.47 25.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.456 1.102 . . . . 0.0 109.833 -172.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -128.77 123.75 33.73 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -71.7 83.12 0.87 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -65.74 105.93 0.65 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.6 112.78 14.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 37.0 m95 -83.89 147.48 27.49 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 177.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 87.9 tttt -62.77 -53.86 47.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.714 0.806 . . . . 0.0 112.33 -166.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.57 1.12 83.67 Favored Glycine 0 CA--C 1.534 1.22 0 N-CA-C 114.058 0.383 . . . . 0.0 114.058 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.649 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 54.5 m95 -116.86 134.99 22.9 Favored Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 123.218 0.607 . . . . 0.0 110.812 -171.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.99 167.68 25.35 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 123.276 2.651 . . . . 0.0 112.712 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -51.45 -28.63 28.49 Favored 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 123.855 3.037 . . . . 0.0 115.34 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -72.73 -28.4 62.63 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.494 0.318 . . . . 0.0 111.318 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -102.86 11.27 37.71 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.49 0.716 . . . . 0.0 111.069 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.443 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.7 m -86.97 137.34 32.44 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 167.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.3 p -110.94 139.22 46.47 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.366 0.666 . . . . 0.0 110.918 -169.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.81 76.32 5.3 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.726 0.811 . . . . 0.0 110.031 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -91.48 122.37 66.02 Favored Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 123.55 0.74 . . . . 0.0 109.218 -178.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 19.1 Cg_exo -68.76 174.98 7.82 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.732 2.288 . . . . 0.0 112.95 177.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.69 -15.58 30.43 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.77 1.228 . . . . 0.0 112.268 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' A' ' 38' ' ' PRO . 40.6 mm-40 -55.35 -42.97 74.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.734 1.214 . . . . 0.0 110.922 173.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 60.3 m170 -105.13 -9.56 17.7 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.765 -171.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.584 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -71.92 112.24 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.596 HD12 ' HB ' ' B' ' 6' ' ' THR . 35.6 mt -71.07 -21.73 62.2 Favored 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -172.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -143.55 128.09 9.53 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 122.825 0.45 . . . . 0.0 110.198 -169.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.48 -35.11 98.89 Favored 'Trans proline' 0 C--N 1.38 2.19 0 C-N-CA 122.79 2.327 . . . . 0.0 112.91 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -67.57 -20.29 65.37 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.693 0.397 . . . . 0.0 111.839 -176.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.584 HD23 HG23 ' A' ' 42' ' ' ILE . 24.0 tp -57.39 -42.78 82.89 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.054 0.388 . . . . 0.0 110.423 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLU . 48.8 t -87.81 -46.74 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.663 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtt -63.7 -46.93 83.24 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.764 0.825 . . . . 0.0 112.53 -172.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.58 -33.44 75.61 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 123.642 0.589 . . . . 0.0 110.683 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -60.36 -48.47 81.62 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.507 0.504 . . . . 0.0 110.445 169.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' VAL . 46.2 mt-10 -71.71 -7.73 49.81 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -173.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -69.22 -26.18 64.68 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 122.987 0.515 . . . . 0.0 111.411 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.547 ' HE2' ' HB3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -158.65 153.92 25.6 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.897 0.479 . . . . 0.0 110.379 -175.548 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -77.64 83.21 4.03 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.299 0.571 . . . . 0.0 110.091 176.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HB3' ' HE2' ' A' ' 54' ' ' LYS . 9.6 tp10 . . . . . 0 CA--C 1.548 0.893 0 C-N-CA 124.618 1.167 . . . . 0.0 107.962 -179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 110.478 -0.193 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -82.93 -5.56 59.1 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.478 0.711 . . . . 0.0 111.3 174.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.2 t -80.66 121.33 25.73 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.388 0.675 . . . . 0.0 110.691 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -127.09 115.89 19.85 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.433 1.093 . . . . 0.0 108.171 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.522 ' HG3' ' HB2' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -126.27 169.25 13.08 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.692 0.797 . . . . 0.0 111.401 -175.104 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.596 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.0 m -148.86 162.08 40.56 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.899 1.28 . . . . 0.0 108.629 -177.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.74 150.52 47.65 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.559 ' HA ' HG12 ' A' ' 4' ' ' VAL . 12.0 mmm-85 -95.98 119.96 35.4 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.423 ' HE2' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.242 0.662 0 CA-C-N 118.066 0.394 . . . . 0.0 110.126 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 32.6 t -66.87 84.56 0.12 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 124.005 0.816 . . . . 0.0 109.453 175.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -84.69 145.13 28.12 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.323 -177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.17 168.4 28.07 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.297 -176.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.9 76.65 0.22 Allowed Glycine 0 C--N 1.34 0.769 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -87.48 124.74 33.77 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.42 0.688 . . . . 0.0 110.752 -176.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.183 0 C-N-CA 124.263 1.025 . . . . 0.0 109.084 -179.061 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.386 0 N-CA-C 112.386 -0.286 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.27 162.42 41.18 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.592 1.157 . . . . 0.0 108.383 179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -142.72 131.27 22.46 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-O 121.07 0.462 . . . . 0.0 110.862 173.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.1 m -99.82 152.3 4.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.386 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -131.19 143.94 50.97 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.859 0.463 . . . . 0.0 110.172 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.19 110.21 4.46 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.175 175.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 18.5 m -97.13 154.56 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.768 0.427 . . . . 0.0 111.295 -172.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 36.1 tt0 -81.08 -69.83 0.58 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 170.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.9 m -166.21 -177.6 4.2 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.836 1.254 . . . . 0.0 109.487 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.9 mm -76.61 142.46 14.3 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 167.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.2 -46.69 4.36 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -143.04 165.07 28.38 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.489 1.116 . . . . 0.0 109.928 175.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -153.69 128.67 9.58 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.783 0.833 . . . . 0.0 108.775 -169.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.409 HH12 ' HD3' ' A' ' 16' ' ' ARG . 3.8 ptm180 -155.85 -174.3 4.9 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.218 1.007 . . . . 0.0 109.467 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p -135.59 129.81 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.409 ' HD3' HH12 ' A' ' 14' ' ' ARG . 54.2 ttp85 -133.74 119.39 19.23 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.151 0.98 . . . . 0.0 109.157 -178.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.86 27.76 16.13 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.403 1.081 . . . . 0.0 111.52 177.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.16 10.87 79.65 Favored Glycine 0 C--N 1.347 1.185 0 CA-C-N 115.607 -0.724 . . . . 0.0 113.442 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -112.47 111.99 23.23 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 70.6 t -70.93 109.88 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -96.62 145.17 25.98 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.432 0.634 . . . . 0.0 110.095 -171.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.442 ' HB3' HD12 ' A' ' 10' ' ' ILE . 96.5 m-85 -127.21 111.49 14.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.589 -1.187 . . . . 0.0 107.869 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.2 tp -66.61 81.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 167.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.411 HG21 ' NE2' ' A' ' 41' ' ' HIS . 95.6 t -77.37 116.15 20.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -78.05 111.2 13.71 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 170.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 5.6 m95 -85.3 140.53 30.75 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.441 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 4.3 tppp? -58.0 -57.36 13.14 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -168.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.44 1.39 88.87 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.924 -177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.699 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 61.8 m95 -115.15 128.2 26.15 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.421 0.689 . . . . 0.0 109.918 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.72 175.67 6.92 Favored 'Trans proline' 0 CA--C 1.572 2.416 0 C-N-CA 123.32 2.68 . . . . 0.0 112.905 -177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -65.11 -13.36 39.37 Favored 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.607 2.204 . . . . 0.0 114.614 -176.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -79.99 -8.72 59.5 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 122.187 -0.321 . . . . 0.0 111.423 173.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -114.9 -8.74 12.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.982 0.913 . . . . 0.0 111.778 174.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.6 p -64.25 117.02 6.59 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 169.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.5 p -122.87 148.2 45.7 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 120.958 0.409 . . . . 0.0 111.745 -169.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -78.74 87.46 4.64 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.646 177.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -102.51 133.74 20.34 Favored Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -69.25 166.57 26.5 Favored 'Trans proline' 0 C--N 1.38 2.195 0 C-N-CA 123.236 2.624 . . . . 0.0 114.135 -171.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.541 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 12.4 pt-20 -49.58 -29.82 7.65 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 126.469 1.907 . . . . 0.0 114.785 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.24 -45.49 91.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.723 0.809 . . . . 0.0 111.55 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.53 ' HB2' ' HB2' ' B' ' 8' ' ' ARG . 2.1 p-80 -62.74 -17.22 60.51 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -172.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.69 111.69 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 C-N-CA 123.315 0.646 . . . . 0.0 109.825 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.589 HD21 ' HG2' ' B' ' 8' ' ' ARG . 53.8 mt -81.8 -15.25 54.81 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 120.908 0.385 . . . . 0.0 111.453 -176.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -144.87 119.7 5.8 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 123.431 0.692 . . . . 0.0 109.662 -164.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.22 -34.19 79.19 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 122.584 2.189 . . . . 0.0 112.269 -178.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' HB2' HE21 ' B' ' 5' ' ' GLN . 34.9 mtt85 -65.77 -20.11 66.14 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.174 0.99 . . . . 0.0 110.774 -173.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 27.1 tp -59.47 -52.03 67.34 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 124.444 1.098 . . . . 0.0 111.272 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 39.4 t -78.85 -35.0 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 123.299 0.639 . . . . 0.0 109.915 -179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.5 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.6 mmt -68.5 -28.83 67.36 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.526 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.9 -30.56 56.23 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 122.882 0.473 . . . . 0.0 111.328 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -61.03 -50.53 72.97 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.138 0.575 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -87.17 -11.75 48.98 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.809 0.844 . . . . 0.0 111.53 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 61.06 37.56 17.79 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.75 1.22 . . . . 0.0 111.006 -177.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 tpmt? -68.83 108.7 3.55 Favored 'General case' 0 C--N 1.351 0.654 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.089 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -91.69 -9.1 45.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.853 0.861 . . . . 0.0 111.14 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 C--O 1.253 1.251 0 C-N-CA 123.749 0.82 . . . . 0.0 109.574 -176.945 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 120.724 0.297 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.76 140.34 40.57 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.809 0.844 . . . . 0.0 109.752 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 42.2 p -70.82 153.21 42.94 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.514 0.509 . . . . 0.0 110.421 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -83.19 90.12 7.05 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.526 HE21 ' HB2' ' A' ' 46' ' ' ARG . 19.2 mp0 -64.3 98.01 0.21 Allowed 'General case' 0 C--N 1.348 0.541 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 163.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.3 p -139.93 162.31 35.48 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 124.338 1.055 . . . . 0.0 109.813 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.519 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.78 141.66 24.71 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.831 -177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.589 ' HG2' HD21 ' A' ' 43' ' ' LEU . 19.5 mmt85 -69.85 179.05 2.37 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.906 0.883 . . . . 0.0 111.849 177.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.799 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.236 160.228 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.7 t -57.85 -35.09 70.44 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.206 0.602 . . . . 0.0 110.759 173.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m 61.58 18.23 9.3 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 124.87 1.268 . . . . 0.0 110.706 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 -97.85 2.26 Favored Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.014 -1.235 . . . . 0.0 110.014 -167.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.58 97.45 0.07 OUTLIER Glycine 0 C--N 1.35 1.337 0 N-CA-C 111.774 -0.53 . . . . 0.0 111.774 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 63.23 20.93 12.56 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.452 1.101 . . . . 0.0 111.525 -172.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.18 0 C-N-CA 124.39 1.076 . . . . 0.0 108.32 179.67 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.63 0 N-CA-C 112.298 -0.321 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.517 ' HA ' HG22 ' B' ' 11' ' ' THR . 46.9 mt-10 -77.97 74.66 4.52 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.764 0.793 . . . . 0.0 109.659 176.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.444 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 85.5 mt-30 -88.41 117.87 27.64 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.012 -171.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.5 m -112.0 123.85 68.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.771 0.828 . . . . 0.0 109.152 176.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.444 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 21.8 m-85 -124.79 162.78 23.54 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.641 0.776 . . . . 0.0 109.588 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.87 112.78 4.47 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.334 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.54 HG21 HD13 ' A' ' 47' ' ' LEU . 32.7 m -74.55 154.34 6.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.283 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.7 tp10 -89.24 -64.96 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 166.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.2 m -165.01 175.2 9.68 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.827 1.251 . . . . 0.0 108.685 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.52 HD11 ' HG ' ' A' ' 47' ' ' LEU . 41.3 mm -78.95 117.71 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 162.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.525 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -72.46 -56.49 5.33 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.525 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.1 mttm -132.76 161.74 33.29 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.411 0.684 . . . . 0.0 110.956 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -146.54 136.55 23.46 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.414 1.085 . . . . 0.0 108.4 -176.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -159.79 177.55 10.71 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.045 0.538 . . . . 0.0 110.303 -173.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 20' ' ' VAL . 22.2 t -130.15 118.27 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 169.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.495 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 13.8 tpt85 -146.12 137.9 24.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.354 1.062 . . . . 0.0 108.895 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 34.1 mtmt 64.99 25.05 12.68 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 124.278 1.031 . . . . 0.0 111.095 -178.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.05 4.83 84.14 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.876 -0.602 . . . . 0.0 113.411 -175.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -116.49 130.82 56.96 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.963 0.905 . . . . 0.0 110.312 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.461 HG22 HG22 ' A' ' 15' ' ' VAL . 46.3 t -79.23 108.29 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 176.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 39.0 mt-10 -101.16 147.26 26.45 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.151 0.581 . . . . 0.0 110.356 -171.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -129.04 123.13 31.53 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.058 0.943 . . . . 0.0 108.902 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.6 tp -76.12 88.07 3.02 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 167.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.5 HG21 ' NE2' ' A' ' 41' ' ' HIS . 91.9 t -78.13 111.3 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.082 0.553 . . . . 0.0 110.116 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 4.9 tmtm? -83.18 132.4 35.07 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -106.36 135.2 48.26 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.454 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 19.9 ttmm -56.27 -59.97 4.18 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -165.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.27 17.98 25.69 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 116.655 -0.248 . . . . 0.0 113.437 -176.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -122.92 134.7 25.2 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.211 1.004 . . . . 0.0 109.542 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -56.27 155.85 23.24 Favored 'Trans proline' 0 CA--C 1.567 2.125 0 C-N-CA 123.464 2.776 . . . . 0.0 113.378 -177.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -47.34 -38.27 26.25 Favored 'Trans proline' 0 C--N 1.383 2.376 0 C-N-CA 124.357 3.371 . . . . 0.0 116.029 -176.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -81.8 -9.05 59.73 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -91.95 10.25 29.67 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.71 0.804 . . . . 0.0 111.53 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.8 m -71.2 137.9 49.08 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 169.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 p -119.78 147.52 44.53 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.863 0.465 . . . . 0.0 111.43 -171.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -94.43 119.59 33.38 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.962 0.905 . . . . 0.0 110.213 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.2 mp0 -138.73 147.53 54.87 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 123.204 0.602 . . . . 0.0 109.631 170.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 16.0 Cg_exo -65.31 177.73 2.44 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 123.251 2.634 . . . . 0.0 113.12 175.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.54 -15.88 59.2 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.794 0.838 . . . . 0.0 112.587 -178.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.82 -23.76 66.75 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.847 1.259 . . . . 0.0 112.766 -176.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.585 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 1.6 p-80 -89.37 -7.26 55.61 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.1 mm -71.08 112.93 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.559 0.744 . . . . 0.0 110.423 -175.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.6 mt -90.28 -10.82 42.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.013 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -150.69 131.01 6.97 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.637 -174.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -61.17 -33.0 91.47 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.174 2.583 . . . . 0.0 113.049 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 39.0 mmt180 -65.32 -15.73 62.84 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.381 0.672 . . . . 0.0 112.092 -177.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.567 ' HB2' ' HB3' ' B' ' 5' ' ' GLN . 14.1 tp -64.57 -48.25 75.69 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.043 0.537 . . . . 0.0 110.737 176.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.3 t -86.32 -32.71 6.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.301 0.64 . . . . 0.0 110.251 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.595 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 52.7 mtt -61.57 -48.96 78.58 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 124.189 0.995 . . . . 0.0 111.396 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.74 -28.46 69.9 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.392 0.677 . . . . 0.0 111.475 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -65.87 -55.62 16.09 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.701 0.401 . . . . 0.0 110.984 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.93 -27.9 35.98 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.714 -170.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -116.08 40.09 2.91 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.6 1.16 . . . . 0.0 109.86 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.475 ' HG2' ' HB3' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -61.94 166.23 4.75 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 114.361 -1.29 . . . . 0.0 113.114 177.315 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.88 -18.99 65.71 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.471 1.108 . . . . 0.0 112.233 -178.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB3' ' HG2' ' A' ' 54' ' ' LYS . 14.4 tp10 . . . . . 0 CA--C 1.555 1.165 0 C-N-CA 124.103 0.961 . . . . 0.0 110.374 174.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.052 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -93.12 -32.5 14.41 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.676 0.79 . . . . 0.0 110.442 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.43 HG21 ' HE3' ' A' ' 27' ' ' LYS . 44.8 p 61.2 11.03 3.28 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 126.143 1.777 . . . . 0.0 114.159 172.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -81.67 -4.83 57.24 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.1 0.96 . . . . 0.0 110.276 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.567 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 24.8 mp0 -70.69 72.27 0.52 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.425 1.49 . . . . 0.0 110.408 178.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 p -82.42 172.37 13.13 Favored 'General case' 0 C--O 1.246 0.878 0 C-N-CA 123.678 0.791 . . . . 0.0 112.158 -170.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -162.8 133.6 4.79 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.859 -169.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -72.67 121.4 19.73 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.834 0.454 . . . . 0.0 110.075 175.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.004 0 CA-C-N 118.033 0.379 . . . . 0.0 111.432 172.376 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 16.8 p -59.05 95.19 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.266 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 171.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.517 HG22 ' HA ' ' A' ' 2' ' ' GLU . 71.0 p -61.27 -34.5 75.27 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.558 1.143 . . . . 0.0 112.031 -169.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -122.1 58.59 0.59 Allowed Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 171.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.57 141.59 37.13 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 112.007 -0.437 . . . . 0.0 112.007 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.81 114.61 10.61 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.287 0.635 . . . . 0.0 110.643 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.17 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 174.509 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -79.78 83.2 5.76 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.34 0.656 . . . . 0.0 109.731 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -77.96 99.34 6.01 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.702 -174.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -97.92 153.38 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.987 0.915 . . . . 0.0 111.351 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.524 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 54.6 m-85 -137.46 156.77 47.78 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.568 1.147 . . . . 0.0 108.152 171.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.516 ' HB1' ' HE2' ' A' ' 27' ' ' LYS . . . -68.81 125.67 27.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.35 0.66 . . . . 0.0 110.522 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.9 m -114.14 154.06 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.377 0.671 . . . . 0.0 110.25 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.51 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 12.7 tp10 -83.82 -69.52 0.63 Allowed 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 172.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.4 m -158.86 -161.14 0.93 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.977 1.311 . . . . 0.0 108.16 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.449 HG23 ' HB3' ' A' ' 22' ' ' TYR . 48.1 mm -90.71 121.7 41.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.866 0 C-N-CA 123.025 0.53 . . . . 0.0 109.98 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -77.41 -55.03 5.73 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.097 0.959 . . . . 0.0 109.836 -179.572 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -135.51 171.64 14.15 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.214 0.606 . . . . 0.0 110.552 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -155.81 143.31 19.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.023 0.529 . . . . 0.0 110.587 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -165.56 163.1 19.41 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.373 1.069 . . . . 0.0 108.556 175.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 14.0 p -101.31 137.82 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 168.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -153.39 127.99 9.37 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.292 0.637 . . . . 0.0 109.552 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 41.7 tptt 65.52 26.26 11.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.748 1.219 . . . . 0.0 111.077 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.82 3.71 90.44 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.524 -177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -119.27 119.16 33.24 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.759 0.824 . . . . 0.0 109.598 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 34.6 t -71.01 107.49 2.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 176.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 9.1 pt-20 -100.16 137.92 37.94 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.993 0.917 . . . . 0.0 109.72 -177.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.449 ' HB3' HG23 ' A' ' 10' ' ' ILE . 42.4 m-85 -116.75 123.19 46.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.115 -1.402 . . . . 0.0 107.838 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 37.7 tp -67.25 88.18 0.18 Allowed 'General case' 0 C--N 1.347 0.475 0 N-CA-C 105.947 -1.872 . . . . 0.0 105.947 165.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -70.86 126.37 31.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 28.1 tptp -77.49 99.86 5.83 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.524 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 62.0 m95 -75.08 105.02 5.89 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 173.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.516 ' HE2' ' HB1' ' A' ' 6' ' ' ALA . 65.5 pttt -70.31 -20.01 63.04 Favored 'General case' 0 N--CA 1.482 1.175 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -162.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.25 -13.06 79.85 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 123.002 0.189 . . . . 0.0 112.653 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -125.17 152.65 71.13 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 109.735 -170.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -71.03 165.1 33.49 Favored 'Trans proline' 0 CA--C 1.567 2.127 0 C-N-CA 122.455 2.103 . . . . 0.0 111.603 172.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.79 -20.64 69.92 Favored 'Trans proline' 0 C--N 1.391 2.804 0 C-N-CA 123.214 2.609 . . . . 0.0 113.793 -174.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -80.2 -29.16 38.57 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.391 0.277 . . . . 0.0 111.6 176.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -87.69 -6.49 58.2 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.044 0.538 . . . . 0.0 110.745 173.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' HD1' ' A' ' 26' ' ' TRP . 49.1 m -78.55 157.91 28.67 Favored 'General case' 0 C--N 1.353 0.754 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.432 ' OG1' HM22 ' B' ' 9' ' ' M3L . 3.2 m -139.37 155.18 47.83 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 120.612 0.244 . . . . 0.0 111.601 -164.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -87.27 92.25 9.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.2 1.0 . . . . 0.0 111.129 -175.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 8' ' ' ARG . 5.3 mp0 -104.78 121.49 46.66 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 124.243 1.017 . . . . 0.0 109.976 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 35.5 Cg_exo -61.44 174.42 2.1 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.933 2.422 . . . . 0.0 114.121 172.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -66.33 -13.81 61.11 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.546 -175.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.9 -25.58 53.15 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.233 0.213 . . . . 0.0 111.377 176.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -80.04 -25.07 40.3 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.533 0.733 . . . . 0.0 111.4 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.643 HG23 HD23 ' A' ' 47' ' ' LEU . 50.4 mm -68.37 127.82 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.045 0.938 . . . . 0.0 110.46 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.624 HD12 ' HB ' ' B' ' 6' ' ' THR . 56.9 mt -77.15 -64.09 1.22 Allowed 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.106 0.479 . . . . 0.0 110.956 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -100.65 133.5 21.18 Favored Pre-proline 0 N--CA 1.472 0.644 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.498 -172.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -59.56 -30.82 93.33 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 123.219 2.613 . . . . 0.0 113.343 -175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.458 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 67.7 mtp180 -69.48 -16.04 63.38 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.58 0.752 . . . . 0.0 112.045 -176.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.643 HD23 HG23 ' A' ' 42' ' ' ILE . 20.2 tp -59.93 -43.57 94.87 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 120.968 0.413 . . . . 0.0 110.642 172.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 77.3 t -82.74 -48.89 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.417 175.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.458 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -65.66 -31.69 72.84 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.645 1.178 . . . . 0.0 113.303 -169.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.25 -37.46 69.12 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-O 120.829 0.347 . . . . 0.0 110.884 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -66.13 -39.16 89.65 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.507 0.723 . . . . 0.0 110.344 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -76.06 -19.52 58.52 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.683 0.793 . . . . 0.0 111.836 178.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 63.2 19.62 11.78 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.531 1.133 . . . . 0.0 110.851 -169.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.74 115.24 27.88 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.584 1.154 . . . . 0.0 110.547 -172.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -77.61 111.28 13.21 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 CA--C 1.568 1.656 0 C-N-CA 126.67 1.988 . . . . 0.0 113.844 -173.262 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -84.5 94.82 8.64 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.581 0.753 . . . . 0.0 110.079 -172.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 70.0 p 47.13 54.69 9.03 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.878 1.671 . . . . 0.0 114.186 173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -93.0 85.81 5.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 173.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.518 ' HB3' HD13 ' A' ' 47' ' ' LEU . 84.6 mm-40 -69.29 129.81 40.83 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 172.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.624 ' HB ' HD12 ' A' ' 43' ' ' LEU . 30.9 m -150.75 157.72 43.29 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 124.003 0.921 . . . . 0.0 109.03 -173.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.81 161.95 36.74 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.953 0.901 . . . . 0.0 109.702 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 37' ' ' GLU . 5.2 mpt_? -86.94 149.78 24.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 168.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.432 HM22 ' OG1' ' A' ' 35' ' ' THR . . . . . . . . 0 N--CA 1.474 0.764 0 C-N-CA 122.806 0.442 . . . . 0.0 110.752 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 14.5 p -80.33 61.76 4.23 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.666 0.787 . . . . 0.0 110.476 175.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 7.2 t -70.41 -25.92 63.44 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.727 0.811 . . . . 0.0 111.266 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -115.89 27.68 8.13 Favored Glycine 0 C--N 1.346 1.119 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 172.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.29 143.29 18.05 Favored Glycine 0 C--N 1.349 1.29 0 C-N-CA 123.229 0.443 . . . . 0.0 112.291 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.18 154.53 17.2 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.95 0.9 . . . . 0.0 109.696 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.881 0 C-N-CA 123.818 0.847 . . . . 0.0 108.722 178.486 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 CA-C-O 120.035 -0.314 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -91.97 130.86 37.63 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.318 0.647 . . . . 0.0 111.127 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -77.7 89.72 3.98 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.65 0.78 . . . . 0.0 109.424 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.578 HG12 ' HG2' ' B' ' 8' ' ' ARG . 31.1 m -101.89 137.76 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.583 0.753 . . . . 0.0 109.788 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -134.21 159.94 39.39 Favored 'General case' 0 C--O 1.245 0.847 0 C-N-CA 124.062 0.945 . . . . 0.0 109.29 173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.59 144.3 32.49 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-N 115.09 -0.959 . . . . 0.0 108.951 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.456 HG21 HD13 ' A' ' 47' ' ' LEU . 22.7 m -91.09 154.81 3.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.552 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.099 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.5 tt0 -82.88 -57.89 3.11 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 160.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -163.52 177.65 8.65 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.917 1.287 . . . . 0.0 109.351 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.1 mm -81.2 114.94 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 162.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -54.84 18.3 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.75 0.82 . . . . 0.0 109.453 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -143.59 169.82 17.0 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.8 0.84 . . . . 0.0 111.092 -179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -149.23 135.41 19.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.53 1.132 . . . . 0.0 108.888 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -160.74 175.51 12.53 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.556 0.743 . . . . 0.0 109.16 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -117.94 114.84 46.55 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.902 0 CA-C-O 121.511 0.672 . . . . 0.0 109.573 170.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -105.9 97.67 7.46 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 124.878 1.271 . . . . 0.0 109.678 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp 62.16 41.88 10.22 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 172.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.13 -15.11 63.67 Favored Glycine 0 N--CA 1.472 1.097 0 CA-C-N 115.88 -0.6 . . . . 0.0 113.301 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm -88.4 109.93 20.41 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.435 0.694 . . . . 0.0 109.2 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.29 106.14 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.594 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 77.5 mt-10 -114.09 150.19 34.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.718 -168.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -122.6 116.7 24.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.438 -1.71 . . . . 0.0 108.2 -176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.0 tp -69.22 104.27 2.16 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.431 HG21 ' NE2' ' A' ' 41' ' ' HIS . 14.8 t -94.08 108.68 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -170.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -76.89 120.73 22.43 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 175.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.1 m95 -93.24 153.26 18.7 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.12 0.568 . . . . 0.0 110.433 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -70.98 -9.27 57.69 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -163.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -149.47 24.17 1.21 Allowed Glycine 0 N--CA 1.474 1.221 0 CA-C-N 117.937 0.335 . . . . 0.0 112.342 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 51.0 m95 -123.4 136.9 27.65 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 124.131 0.972 . . . . 0.0 108.484 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -59.13 159.76 21.12 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 122.941 2.427 . . . . 0.0 112.959 -175.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -53.39 -30.2 51.78 Favored 'Trans proline' 0 C--N 1.382 2.297 0 C-N-CA 123.393 2.729 . . . . 0.0 114.278 179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.1 -15.02 58.76 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -99.85 17.24 21.3 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.598 0.759 . . . . 0.0 111.698 176.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -81.1 141.19 34.54 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.2 p -110.19 130.13 55.6 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -169.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -72.58 96.46 1.97 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.838 0.455 . . . . 0.0 109.986 170.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -123.47 131.58 24.29 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.155 0.982 . . . . 0.0 109.92 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.594 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 84.4 Cg_endo -70.59 170.63 17.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.131 2.554 . . . . 0.0 113.672 -175.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -53.39 -17.11 1.67 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.847 1.259 . . . . 0.0 114.316 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.29 -39.24 89.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.933 0.893 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.47 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 9.3 p-80 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.806 0.442 . . . . 0.0 111.996 -177.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.8 mm -67.85 116.01 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 124.324 1.049 . . . . 0.0 110.515 -175.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.2 mt -99.22 8.55 44.7 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.954 0.502 . . . . 0.0 111.348 -176.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -150.08 118.98 3.7 Favored Pre-proline 0 N--CA 1.483 1.199 0 C-N-CA 123.581 0.753 . . . . 0.0 109.714 -179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -63.47 -36.8 52.55 Favored 'Trans proline' 0 N--CA 1.504 2.127 0 C-N-CA 122.954 2.436 . . . . 0.0 112.576 -177.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 ttp180 -65.12 -22.33 66.92 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 125.221 1.408 . . . . 0.0 111.469 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.456 HD13 HG21 ' A' ' 7' ' ' VAL . 16.9 tp -59.56 -52.17 66.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.816 0.846 . . . . 0.0 111.375 174.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.88 -42.23 77.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.569 0.699 . . . . 0.0 111.02 178.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -74.46 -26.81 60.27 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.649 -171.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.93 -29.05 55.47 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.126 0.571 . . . . 0.0 111.11 175.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.5 t80 -59.44 -45.75 90.7 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.529 0.731 . . . . 0.0 109.953 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.87 -16.95 49.02 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.581 178.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 69.06 5.93 5.35 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 125.177 1.391 . . . . 0.0 113.259 173.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -80.52 152.83 28.48 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 80.38 -15.69 0.72 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 125.831 1.653 . . . . 0.0 112.161 -174.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 C--O 1.251 1.173 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.382 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -82.36 72.6 9.43 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 23.6 m -91.91 148.54 22.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.19 0.996 . . . . 0.0 109.095 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -69.48 82.88 0.4 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.736 0.779 . . . . 0.0 110.563 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -108.84 80.81 1.37 Allowed 'General case' 0 C--O 1.237 0.417 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.4 p -76.06 148.39 38.01 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.268 -176.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.47 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -148.94 132.3 16.56 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.299 -0.864 . . . . 0.0 109.824 -173.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG2' HG12 ' A' ' 4' ' ' VAL . 23.4 mtm180 -84.44 170.41 13.57 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.207 0.603 . . . . 0.0 111.074 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.47 HM11 ' CE2' ' A' ' 29' ' ' TRP . . . . . . . . 0 N--CA 1.479 1.009 0 C-N-CA 123.719 0.808 . . . . 0.0 108.838 171.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 79.3 p -161.48 -174.38 4.24 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.463 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -150.31 159.48 44.42 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.881 0.873 . . . . 0.0 109.485 175.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.75 -60.32 0.87 Allowed Glycine 0 C--N 1.343 0.936 0 CA-C-O 120.001 -0.333 . . . . 0.0 112.977 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 58.36 35.38 78.71 Favored Glycine 0 C--N 1.352 1.419 0 O-C-N 123.748 0.323 . . . . 0.0 112.971 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -87.99 135.51 33.38 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.95 0.9 . . . . 0.0 111.083 -172.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.31 0 C-N-CA 123.975 0.91 . . . . 0.0 108.68 172.931 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.528 0 N-CA-C 111.296 -0.721 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -98.27 98.47 9.73 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.161 0.984 . . . . 0.0 109.926 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -82.19 138.66 34.63 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.551 0.74 . . . . 0.0 111.112 -175.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.4 HG12 ' HG2' ' B' ' 8' ' ' ARG . 35.5 m -85.5 138.62 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.688 0.795 . . . . 0.0 110.756 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -131.12 157.61 42.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.764 0.826 . . . . 0.0 109.771 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.17 107.22 10.6 Favored 'General case' 0 C--O 1.244 0.775 0 C-N-CA 123.578 0.751 . . . . 0.0 109.333 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.91 154.2 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.832 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 32.1 tt0 -93.44 -52.94 4.27 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.409 0.683 . . . . 0.0 109.668 177.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.3 m -161.93 168.21 23.3 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.67 1.188 . . . . 0.0 109.839 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.459 HD13 HG22 ' A' ' 24' ' ' VAL . 32.4 mm -77.28 115.07 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 162.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.437 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.3 OUTLIER -69.86 -58.61 3.67 Favored 'General case' 0 CA--C 1.556 1.177 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.082 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.437 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.0 mtpp -139.08 171.48 14.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.978 0.911 . . . . 0.0 110.994 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -154.32 133.05 12.2 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.651 1.18 . . . . 0.0 108.569 -171.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -160.23 179.57 8.58 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.981 0.913 . . . . 0.0 110.074 178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 8.9 p -129.81 138.04 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 123.461 0.704 . . . . 0.0 109.966 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -138.74 100.68 4.13 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.503 1.121 . . . . 0.0 108.904 -172.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp 60.59 36.86 19.71 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.127 0.971 . . . . 0.0 111.43 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.58 -10.77 73.52 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 114.96 -1.018 . . . . 0.0 113.2 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -99.8 108.84 21.24 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.218 0.607 . . . . 0.0 110.18 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 59.9 t -76.95 112.31 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.608 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -96.27 139.3 32.61 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.669 0.788 . . . . 0.0 109.835 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -118.72 110.18 16.96 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.7 tp -69.84 105.37 2.76 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 167.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.584 HG21 ' HE1' ' A' ' 41' ' ' HIS . 76.2 t -101.05 118.88 48.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -77.39 115.66 17.34 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 171.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 11.1 m95 -90.38 144.44 25.81 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 30.5 ttmt -64.23 -53.85 42.75 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -166.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.83 1.46 86.28 Favored Glycine 0 CA--C 1.533 1.172 0 N-CA-C 113.798 0.279 . . . . 0.0 113.798 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.529 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.6 m95 -114.81 135.8 22.44 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.741 0.816 . . . . 0.0 109.322 -177.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -64.51 160.7 38.41 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 C-N-CA 122.467 2.111 . . . . 0.0 112.038 179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.52 -22.25 21.22 Favored 'Trans proline' 0 C--N 1.384 2.416 0 C-N-CA 123.531 2.821 . . . . 0.0 114.48 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -77.39 -35.78 54.03 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.507 0.323 . . . . 0.0 111.489 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -82.9 0.38 44.58 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.071 0.549 . . . . 0.0 111.242 176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.1 m -70.67 140.83 51.62 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.43 0.692 . . . . 0.0 109.669 171.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -132.06 156.49 46.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.267 0.627 . . . . 0.0 111.811 -167.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -95.41 112.28 24.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.528 1.131 . . . . 0.0 109.351 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.569 ' HG2' ' HA ' ' B' ' 9' ' ' M3L . 18.3 mp0 -116.95 144.39 33.41 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 123.612 0.765 . . . . 0.0 109.435 172.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.82 160.5 49.42 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 123.081 2.521 . . . . 0.0 112.171 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -50.33 -28.59 8.17 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 125.921 1.688 . . . . 0.0 114.629 -167.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.748 ' HG2' HH22 ' B' ' 8' ' ' ARG . 39.4 tt0 -64.1 -30.11 71.2 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.587 0.755 . . . . 0.0 112.224 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.584 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.1 p80 -64.1 -22.52 66.97 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.5 mm -67.48 114.24 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.18 0.592 . . . . 0.0 109.53 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.3 mt -85.04 -63.88 1.25 Allowed 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -77.75 118.37 71.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 CA-C-N 114.549 -1.205 . . . . 0.0 110.003 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.79 -25.61 39.38 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.501 2.134 . . . . 0.0 111.961 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.8 mtp180 -70.98 -16.69 62.65 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.667 0.787 . . . . 0.0 111.03 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' B' ' 5' ' ' GLN . 14.5 tp -60.48 -52.92 63.16 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.964 . . . . 0.0 111.255 172.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 61.2 t -76.35 -38.65 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 123.274 0.63 . . . . 0.0 109.764 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.7 mtm -67.95 -27.99 67.08 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.229 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.24 -43.85 49.3 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.976 0.353 . . . . 0.0 110.051 175.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -56.19 -54.81 40.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.056 0.542 . . . . 0.0 111.15 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -79.21 -7.79 58.52 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.971 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 60.01 32.35 21.04 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.768 1.227 . . . . 0.0 110.783 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.526 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -76.92 84.14 3.47 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.045 -175.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -85.03 78.02 9.98 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 CA--C 1.551 1.007 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.468 -171.829 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.372 0.13 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -72.15 97.59 1.97 Allowed 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.615 0.722 . . . . 0.0 111.415 -177.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 62.5 m -64.42 -44.21 91.93 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.342 173.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt 55.05 78.45 0.18 Allowed 'General case' 0 C--O 1.244 0.776 0 C-N-CA 125.026 1.33 . . . . 0.0 110.982 -172.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.486 ' HB2' HD13 ' A' ' 47' ' ' LEU . 21.7 pt20 -59.36 114.34 2.62 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 113.77 -1.559 . . . . 0.0 109.514 169.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 11.2 m -127.11 141.65 51.71 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.279 0.632 . . . . 0.0 110.37 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.84 148.76 31.23 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.136 0.974 . . . . 0.0 109.819 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.748 HH22 ' HG2' ' A' ' 40' ' ' GLU . 70.3 mtm-85 -86.35 176.08 8.08 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.218 0.607 . . . . 0.0 110.783 -179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.569 ' HA ' ' HG2' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.477 0.885 0 C-N-CA 122.752 0.421 . . . . 0.0 110.84 169.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 37.2 t -78.55 159.23 28.26 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 12.5 t -141.09 157.14 45.71 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 123.775 0.83 . . . . 0.0 109.269 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.76 -44.35 3.24 Favored Glycine 0 CA--C 1.534 1.236 0 N-CA-C 111.859 -0.497 . . . . 0.0 111.859 -175.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.35 158.25 34.02 Favored Glycine 0 C--N 1.35 1.359 0 N-CA-C 112.099 -0.4 . . . . 0.0 112.099 -177.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -153.72 158.7 41.39 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 123.127 0.571 . . . . 0.0 111.375 -177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.555 1.143 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.735 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.941 0 N-CA-C 112.029 -0.429 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -126.76 44.49 2.88 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.827 0.851 . . . . 0.0 110.458 -172.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.494 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 26.3 mp0 -73.91 124.24 25.79 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.171 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 m -115.72 125.61 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.948 0.899 . . . . 0.0 110.439 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.494 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 83.4 m-85 -122.36 155.89 35.08 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.011 0.524 . . . . 0.0 110.499 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.45 110.32 3.08 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.546 -1.206 . . . . 0.0 110.072 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.624 HG21 HD13 ' A' ' 47' ' ' LEU . 16.4 m -84.16 154.66 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.54 0.736 . . . . 0.0 110.391 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.2 tt0 -91.23 -65.64 1.0 Allowed 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 171.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.3 m -163.44 175.51 10.7 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.329 1.452 . . . . 0.0 108.251 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.509 HD12 ' HB3' ' A' ' 22' ' ' TYR . 34.7 mm -74.78 119.86 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 165.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -74.19 -45.04 50.93 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -156.38 159.69 38.98 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.237 0.615 . . . . 0.0 109.928 -175.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -149.91 147.55 28.05 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.328 0.651 . . . . 0.0 109.905 -172.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -168.2 -173.99 2.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.22 1.008 . . . . 0.0 109.323 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -126.56 123.13 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.737 0.815 . . . . 0.0 108.893 173.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -150.07 150.35 31.6 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.93 24.85 13.78 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.625 1.17 . . . . 0.0 111.128 -173.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 67.71 16.05 67.38 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-N 116.102 -0.499 . . . . 0.0 113.235 -174.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -126.7 145.85 50.43 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.466 1.106 . . . . 0.0 109.219 -177.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.18 112.5 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -96.08 140.67 30.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.406 0.683 . . . . 0.0 109.977 -175.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HB3' HD12 ' A' ' 10' ' ' ILE . 93.3 m-85 -125.97 109.8 12.87 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.993 0.917 . . . . 0.0 109.077 -179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.7 tp -68.87 89.44 0.4 Allowed 'General case' 0 C--N 1.344 0.355 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.546 HG21 ' NE2' ' A' ' 41' ' ' HIS . 89.9 t -85.93 115.98 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 122.85 0.46 . . . . 0.0 109.886 -174.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -79.23 111.38 15.41 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.3 m95 -83.41 130.01 35.02 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.9 ttpt -62.09 -51.23 68.77 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -166.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.08 8.78 59.5 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 123.204 0.315 . . . . 0.0 113.658 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 65.8 m95 -123.42 137.96 29.33 Favored Pre-proline 0 CA--C 1.546 0.806 0 C-N-CA 124.084 0.954 . . . . 0.0 109.338 -174.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.506 ' HG2' ' CD1' ' A' ' 33' ' ' TYR . 29.7 Cg_endo -63.87 153.7 74.13 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 122.946 2.431 . . . . 0.0 113.212 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -38.53 -47.95 2.55 Favored 'Trans proline' 0 C--N 1.389 2.707 1 C-N-CA 125.888 4.392 . . . . 0.0 117.293 -171.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -72.36 -17.58 61.82 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -171.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.506 ' CD1' ' HG2' ' A' ' 30' ' ' PRO . 76.8 m-85 -84.6 7.54 19.82 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.246 0.618 . . . . 0.0 111.961 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.6 p -68.49 124.24 23.03 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 167.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 p -112.33 142.15 45.19 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.158 0.583 . . . . 0.0 111.086 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -77.14 81.71 3.65 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.784 0.834 . . . . 0.0 109.17 176.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -94.08 127.51 44.69 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.174 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -72.43 175.84 9.52 Favored 'Trans proline' 0 C--N 1.374 1.892 0 C-N-CA 122.425 2.083 . . . . 0.0 113.263 -173.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.07 -34.2 9.27 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.794 1.637 . . . . 0.0 113.797 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -58.58 -30.02 66.86 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.737 1.215 . . . . 0.0 112.934 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.568 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.0 p-80 -84.48 -16.76 41.34 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -170.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.4 mm -67.31 123.37 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.065 0.546 . . . . 0.0 109.882 -176.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.554 HD21 ' HG2' ' B' ' 8' ' ' ARG . 30.0 mt -99.22 -44.82 6.11 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 120.822 0.344 . . . . 0.0 110.469 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 26.3 t70 -110.74 129.27 24.14 Favored Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.67 -176.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -67.26 -27.03 41.38 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 123.107 2.538 . . . . 0.0 113.571 -175.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.659 ' HB2' HE21 ' B' ' 5' ' ' GLN . 41.4 mmt180 -70.13 -15.68 63.0 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.947 0.499 . . . . 0.0 111.507 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.624 HD13 HG21 ' A' ' 7' ' ' VAL . 18.9 tp -58.91 -44.43 91.25 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 123.549 0.74 . . . . 0.0 110.368 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.6 t -89.13 -35.9 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.316 0.646 . . . . 0.0 110.664 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.598 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 75.8 mmm -68.76 -33.94 74.74 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.028 0.931 . . . . 0.0 112.243 -175.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -72.07 -28.42 63.32 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.582 0.353 . . . . 0.0 110.497 175.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -75.24 -45.42 40.26 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.242 1.017 . . . . 0.0 111.65 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -84.44 -55.75 3.98 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.855 0.462 . . . . 0.0 111.059 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -92.34 81.11 4.93 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -69.16 145.43 53.29 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.423 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -73.82 -11.5 60.4 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.146 174.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 . . . . . 0 C--O 1.252 1.216 0 C-N-CA 124.78 1.232 . . . . 0.0 109.305 168.944 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.789 0 CA-C-O 120.642 0.258 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -77.58 -4.96 48.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.195 0.598 . . . . 0.0 112.525 -177.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 6.4 t -67.1 89.28 0.18 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 122.518 1.152 . . . . 0.0 109.275 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.488 ' HG3' HG23 ' B' ' 6' ' ' THR . 17.9 tppt? -149.78 126.22 10.86 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.337 -172.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.659 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.4 mp0 -72.18 103.23 3.27 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.488 HG23 ' HG3' ' B' ' 4' ' ' LYS . 5.1 p -122.98 162.91 21.41 Favored 'General case' 0 C--O 1.248 1.021 0 C-N-CA 124.079 0.952 . . . . 0.0 110.22 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.568 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -157.19 126.69 6.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.408 -172.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.554 ' HG2' HD21 ' A' ' 43' ' ' LEU . 14.8 mmt85 -68.51 157.56 35.7 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.604 0.762 . . . . 0.0 110.143 172.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.405 ' HE2' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.473 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 109.654 170.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 33.2 t -68.88 87.97 0.37 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.373 1.069 . . . . 0.0 108.748 173.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 10.5 m -77.6 81.47 4.04 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.065 -174.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.27 -76.58 1.45 Allowed Glycine 0 C--N 1.347 1.181 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.713 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.8 104.0 0.66 Allowed Glycine 0 C--N 1.351 1.383 0 C-N-CA 123.473 0.558 . . . . 0.0 113.281 -177.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.67 -174.91 2.97 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.676 1.19 . . . . 0.0 109.719 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.283 0 C-N-CA 123.099 0.559 . . . . 0.0 110.222 179.189 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -87.02 -14.66 40.96 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 110.845 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -71.84 104.89 3.59 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.309 1.044 . . . . 0.0 111.707 -168.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.2 m -74.78 140.1 18.07 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.126 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -134.29 141.7 47.04 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 171.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.13 113.19 4.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.294 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.45 HG22 ' O ' ' B' ' 5' ' ' GLN . 15.9 m -90.07 154.55 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 123.019 0.527 . . . . 0.0 111.132 -173.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -84.18 -68.98 0.67 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 168.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.7 m -159.4 -179.6 8.09 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mm -83.0 121.36 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -60.21 2.35 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.252 1.021 . . . . 0.0 108.54 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -137.67 169.82 17.13 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.956 0.902 . . . . 0.0 110.523 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -153.65 128.17 9.29 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.814 0.846 . . . . 0.0 109.083 -170.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -162.61 -173.74 3.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.222 1.009 . . . . 0.0 110.104 -176.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.38 143.89 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.148 169.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 4.1 ttm180 -147.98 115.07 6.16 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.108 0.963 . . . . 0.0 108.614 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 55.5 mtpt 63.84 32.43 13.39 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.159 0.984 . . . . 0.0 111.851 172.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.47 -15.15 63.01 Favored Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.261 -0.881 . . . . 0.0 113.021 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -96.58 110.68 23.04 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.689 0.796 . . . . 0.0 109.588 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.98 109.49 8.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -97.62 137.97 35.73 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 122.747 0.419 . . . . 0.0 110.32 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -115.51 110.22 18.95 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 167.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.1 tp -67.13 101.79 0.94 Allowed 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 167.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.476 HG21 ' HE1' ' A' ' 41' ' ' HIS . 71.9 t -97.42 122.62 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 122.221 0.209 . . . . 0.0 111.092 -172.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -78.57 119.46 21.87 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 49.6 m95 -89.0 140.55 29.32 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.97 0.908 . . . . 0.0 109.429 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 0.1 OUTLIER -62.0 -51.46 67.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.063 0.545 . . . . 0.0 112.399 -168.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.43 9.14 78.12 Favored Glycine 0 C--N 1.346 1.084 0 N-CA-C 114.071 0.388 . . . . 0.0 114.071 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 42.9 m95 -127.84 137.62 31.15 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 -175.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -64.2 159.01 45.27 Favored 'Trans proline' 0 C--N 1.377 2.044 0 C-N-CA 122.608 2.205 . . . . 0.0 111.812 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -60.09 -11.73 16.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.61 2.873 . . . . 0.0 115.708 -171.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -80.32 -18.32 49.51 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 118.851 0.75 . . . . 0.0 111.323 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -88.91 2.22 54.13 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.739 0.815 . . . . 0.0 111.407 172.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 t -64.13 123.53 19.3 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.2 p -119.1 156.82 29.05 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.689 0.796 . . . . 0.0 110.912 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -95.17 116.21 28.43 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.785 0.834 . . . . 0.0 108.833 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -119.5 149.76 48.49 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 123.497 0.719 . . . . 0.0 109.381 171.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.16 149.56 81.89 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 121.943 1.762 . . . . 0.0 110.409 168.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -56.6 -16.38 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.522 1.129 . . . . 0.0 113.991 -168.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.63 -28.44 65.66 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.757 1.223 . . . . 0.0 112.477 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.476 ' HE1' HG21 ' A' ' 24' ' ' VAL . 1.2 p80 -72.9 -15.6 61.58 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.504 HG21 HG23 ' A' ' 48' ' ' VAL . 37.4 mm -69.89 120.37 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 123.599 0.759 . . . . 0.0 109.666 -177.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.509 HD21 ' HG3' ' B' ' 8' ' ' ARG . 26.0 mt -86.58 -15.41 39.94 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.616 0.366 . . . . 0.0 111.344 -177.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -147.9 125.86 5.91 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-O 119.003 -0.522 . . . . 0.0 111.201 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -55.61 -31.74 80.45 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.785 2.99 . . . . 0.0 113.86 -177.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.452 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 34.3 mmt180 -65.22 -16.8 63.93 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.413 HD13 HG21 ' A' ' 7' ' ' VAL . 13.3 tp -69.61 -48.42 60.15 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.182 0.593 . . . . 0.0 110.595 173.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.504 HG23 HG21 ' A' ' 42' ' ' ILE . 26.1 t -69.01 -39.47 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 CA-C-O 121.439 0.638 . . . . 0.0 109.903 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 93.5 mtp -69.81 -32.57 71.09 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 114.328 -1.305 . . . . 0.0 111.236 -176.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -28.62 69.84 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.357 0.663 . . . . 0.0 111.639 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -64.48 -55.31 21.55 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.486 0.714 . . . . 0.0 110.85 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -87.96 -45.79 9.93 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.357 0.663 . . . . 0.0 110.462 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -83.77 66.67 9.18 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 168.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.614 ' H ' ' HD3' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -69.57 152.15 45.12 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.528 -174.157 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 64.65 24.86 13.02 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.716 1.207 . . . . 0.0 111.694 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 124.003 0.921 . . . . 0.0 109.514 176.409 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 38.7 mmt180 -77.78 95.12 4.61 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 10.0 t -162.04 168.6 22.45 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 124.149 0.98 . . . . 0.0 109.528 -175.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -118.88 72.1 0.87 Allowed 'General case' 0 C--O 1.247 0.935 0 C-N-CA 123.605 0.762 . . . . 0.0 109.499 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.45 ' O ' HG22 ' A' ' 7' ' ' VAL . 5.2 pm0 -65.15 123.05 18.5 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 169.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -136.43 165.74 25.11 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 123.881 0.872 . . . . 0.0 110.796 -169.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.439 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -153.44 140.08 18.89 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.671 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.509 ' HG3' HD21 ' A' ' 43' ' ' LEU . 70.0 mtm180 -79.52 145.28 33.28 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.02 0.528 . . . . 0.0 109.673 174.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.23 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.478 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 36.2 t -74.64 177.67 5.94 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.573 1.149 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 15.1 t -131.95 14.79 4.77 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.86 172.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.79 32.49 61.21 Favored Glycine 0 C--N 1.355 1.633 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.408 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.82 -80.93 1.11 Allowed Glycine 0 C--N 1.343 0.946 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -164.22 125.71 2.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.091 0.557 . . . . 0.0 110.233 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 174.816 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.539 ' HA ' ' O ' ' B' ' 9' ' ' M3L . 5.3 mp0 -84.67 75.35 10.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.259 1.024 . . . . 0.0 109.187 -174.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -112.28 140.59 46.87 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.73 0.812 . . . . 0.0 110.195 -172.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.5 m -82.73 138.07 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 122.989 0.516 . . . . 0.0 110.58 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -135.06 146.1 48.61 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 123.832 0.853 . . . . 0.0 108.947 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.65 120.61 13.76 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.742 0.817 . . . . 0.0 109.55 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 9.5 m -95.78 153.48 3.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 C-N-CA 123.03 0.532 . . . . 0.0 110.183 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 36.0 tt0 -86.57 -65.59 1.0 Allowed 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 170.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -158.79 -179.27 7.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.373 1.069 . . . . 0.0 109.168 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 37.6 mm -88.93 121.88 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 163.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -62.4 1.65 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -125.15 171.58 10.2 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.434 0.694 . . . . 0.0 111.476 -176.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -155.27 144.44 20.94 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 109.68 -173.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 39.1 ptt180 -168.56 -175.98 2.65 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.259 1.024 . . . . 0.0 109.41 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.14 127.9 20.8 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 52.2 ttt-85 -140.69 125.81 18.49 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HG2' ' HG2' ' A' ' 16' ' ' ARG . 72.7 mmtt 64.44 25.16 13.3 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.48 1.112 . . . . 0.0 111.507 -179.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.1 -6.65 74.53 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.156 -0.474 . . . . 0.0 113.204 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -89.89 110.6 21.54 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.021 0.928 . . . . 0.0 108.905 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 19.8 t -77.88 105.47 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.71 137.3 36.82 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.264 0.626 . . . . 0.0 110.019 -169.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -126.51 112.57 15.72 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.9 tp -69.2 86.91 0.4 Allowed 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 173.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.3 t -71.34 112.6 6.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 C-N-CA 123.199 0.6 . . . . 0.0 109.656 -177.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -77.55 110.53 12.43 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 171.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.3 m95 -82.71 153.71 25.19 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 39.6 ttmt -70.8 -60.84 2.02 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.138 0.575 . . . . 0.0 112.33 -167.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.07 6.83 77.84 Favored Glycine 0 N--CA 1.469 0.867 0 CA-C-N 116.252 -0.431 . . . . 0.0 113.13 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 53.9 m95 -118.06 134.64 23.31 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.223 1.009 . . . . 0.0 109.072 -177.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -67.83 171.4 12.29 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.795 2.33 . . . . 0.0 111.858 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.5 -14.53 44.89 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 122.78 2.32 . . . . 0.0 113.664 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -83.28 -6.72 59.57 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.303 0.641 . . . . 0.0 112.227 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -114.94 13.22 17.0 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.031 0.932 . . . . 0.0 110.613 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.2 m -82.37 133.42 35.22 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 27.3 p -116.16 143.39 45.56 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.912 0.885 . . . . 0.0 110.494 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -71.09 82.12 0.69 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 170.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -101.33 109.48 58.92 Favored Pre-proline 0 C--O 1.239 0.534 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.551 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.45 162.95 31.59 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.537 2.158 . . . . 0.0 113.336 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -54.05 -26.55 27.2 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.178 1.391 . . . . 0.0 112.165 174.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -56.27 -31.88 64.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.275 1.43 . . . . 0.0 111.628 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -113.36 -10.93 13.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.887 0.875 . . . . 0.0 112.097 -174.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 44.3 mm -65.61 141.63 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 170.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.9 pp -113.38 -12.25 13.03 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 119.812 1.187 . . . . 0.0 112.214 178.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -101.26 117.02 63.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 173.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.12 -38.0 93.31 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.438 2.092 . . . . 0.0 110.323 166.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.67 ' HG3' HG22 ' B' ' 3' ' ' THR . 21.2 mmm180 -62.3 -23.25 66.63 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.194 0.998 . . . . 0.0 113.292 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 19.5 tp -66.52 -52.52 44.93 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 118.26 0.482 . . . . 0.0 110.674 178.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 90.7 t -72.94 -37.61 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.034 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.408 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 61.4 mtt -60.5 -38.83 85.59 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.705 0.802 . . . . 0.0 111.268 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.06 -33.96 76.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.577 0.751 . . . . 0.0 110.581 178.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -69.06 -41.27 77.82 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.344 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.0 mm-40 -64.86 -39.6 93.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 122.74 0.416 . . . . 0.0 110.845 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -92.68 9.87 33.03 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.601 0.76 . . . . 0.0 111.735 -177.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.537 ' HG2' ' HG3' ' A' ' 56' ' ' GLU . 18.8 ttpp -56.65 119.57 6.35 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.154 0.981 . . . . 0.0 111.706 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -75.2 89.57 2.53 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.222 1.009 . . . . 0.0 111.025 -177.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.537 ' HG3' ' HG2' ' A' ' 54' ' ' LYS . 58.8 mt-10 . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 59.04 27.83 16.89 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.419 1.088 . . . . 0.0 110.891 -174.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.67 HG22 ' HG3' ' A' ' 46' ' ' ARG . 31.4 p -106.98 79.29 1.31 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.856 1.262 . . . . 0.0 109.366 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.16 -32.33 30.05 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.777 0.831 . . . . 0.0 110.488 -176.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 61.49 69.55 0.65 Allowed 'General case' 0 CA--C 1.551 1.018 0 O-C-N 124.702 1.251 . . . . 0.0 109.01 -174.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.589 ' HB ' HD11 ' A' ' 43' ' ' LEU . 27.2 m -150.72 145.15 25.61 Favored 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 123.99 0.916 . . . . 0.0 111.278 -169.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -131.36 149.66 52.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.082 0.953 . . . . 0.0 109.615 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.46 ' HG3' HD23 ' A' ' 43' ' ' LEU . 78.9 mtm180 -93.71 126.52 38.93 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.075 0.95 . . . . 0.0 108.921 175.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.539 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--O 1.222 -0.39 0 O-C-N 123.395 0.434 . . . . 0.0 110.07 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.8 t -66.44 -28.1 68.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.814 0.446 . . . . 0.0 110.269 170.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.405 HG23 ' HB2' ' B' ' 9' ' ' M3L . 29.9 p 52.47 46.22 27.1 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.151 1.38 . . . . 0.0 111.751 -179.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.78 91.35 0.26 Allowed Glycine 0 C--N 1.348 1.229 0 CA-C-N 114.858 -1.064 . . . . 0.0 112.394 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.26 -42.68 99.23 Favored Glycine 0 C--N 1.354 1.56 0 O-C-N 123.757 0.328 . . . . 0.0 112.814 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -86.04 103.27 14.57 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 172.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.952 0 C-N-CA 123.62 0.768 . . . . 0.0 109.092 179.627 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.707 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -66.57 90.66 0.17 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.156 0.583 . . . . 0.0 111.051 -176.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -78.78 84.43 4.85 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.739 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.53 143.25 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.842 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.467 ' CD1' ' HE2' ' B' ' 9' ' ' M3L . 26.0 m-85 -139.93 150.59 44.73 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.063 0.945 . . . . 0.0 109.702 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.91 131.12 45.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.925 176.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.5 m -116.46 154.27 18.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 123.129 0.571 . . . . 0.0 111.383 -175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 26.3 tt0 -85.14 -58.79 2.54 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.441 1.096 . . . . 0.0 108.503 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.8 m -174.95 -178.65 1.27 Allowed 'General case' 0 C--O 1.243 0.751 0 C-N-CA 126.525 1.93 . . . . 0.0 108.025 178.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.517 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 45.0 mm -78.18 124.5 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 168.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -61.14 1.9 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.64 0.776 . . . . 0.0 109.123 176.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.429 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 67.4 mttm -133.99 156.64 47.82 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.856 0.863 . . . . 0.0 110.148 178.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -145.68 141.72 28.35 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.425 0.69 . . . . 0.0 109.466 -176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -165.21 -173.17 2.77 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.398 1.079 . . . . 0.0 109.357 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.6 p -135.39 119.33 25.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.408 0.623 . . . . 0.0 110.359 175.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -102.21 97.62 7.88 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.187 0.995 . . . . 0.0 108.731 173.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp 56.58 52.75 9.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.357 1.063 . . . . 0.0 113.096 168.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 -3.19 85.85 Favored Glycine 0 C--N 1.346 1.106 0 CA-C-N 115.731 -0.668 . . . . 0.0 113.561 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -111.89 111.76 22.94 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 36.9 t -77.77 112.94 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 -178.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -96.8 138.06 34.93 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.13 0.972 . . . . 0.0 109.876 -171.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.5 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.0 m-85 -127.74 110.14 12.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.162 0.985 . . . . 0.0 109.246 -178.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.429 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.5 tp -69.68 101.69 1.72 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 106.935 -1.505 . . . . 0.0 106.935 165.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.521 HG21 ' NE2' ' A' ' 41' ' ' HIS . 25.6 t -93.21 117.72 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 122.495 0.318 . . . . 0.0 110.383 -171.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -80.13 110.9 15.97 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 56.9 m95 -85.55 77.67 9.82 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-O 121.131 0.491 . . . . 0.0 109.895 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 85.2 tttt 52.56 -91.15 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.907 1.683 . . . . 0.0 113.022 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -121.61 14.17 9.27 Favored Glycine 0 C--N 1.352 1.441 0 C-N-CA 122.877 0.275 . . . . 0.0 113.037 -173.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 25.4 m95 -70.84 129.17 90.01 Favored Pre-proline 0 N--CA 1.473 0.698 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 171.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.42 146.4 62.76 Favored 'Trans proline' 0 C--N 1.379 2.15 0 C-N-CA 122.866 2.377 . . . . 0.0 112.068 -175.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -44.74 -29.08 3.25 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 124.623 3.549 . . . . 0.0 116.865 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -74.37 -7.46 52.95 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -104.98 0.98 28.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.998 0.919 . . . . 0.0 111.745 177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.6 p -71.94 123.29 22.4 Favored 'General case' 0 C--N 1.351 0.666 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 171.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.0 p -114.42 139.3 49.61 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 0.0 111.934 -169.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -77.49 86.3 3.85 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.328 1.051 . . . . 0.0 110.06 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -101.52 137.78 19.7 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.012 0.925 . . . . 0.0 109.916 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.11 161.41 26.4 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 122.208 1.938 . . . . 0.0 112.634 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -38.37 -33.08 0.09 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 127.291 2.236 . . . . 0.0 116.196 -171.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -66.78 -30.03 70.14 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.05 0.94 . . . . 0.0 112.635 -172.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.521 ' NE2' HG21 ' A' ' 24' ' ' VAL . 6.5 p-80 -71.77 -12.54 61.35 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.8 mm -71.54 128.95 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 118.181 -0.914 . . . . 0.0 109.086 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.577 HD11 ' HB ' ' B' ' 6' ' ' THR . 3.6 pp -108.52 -4.49 17.19 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 119.818 1.19 . . . . 0.0 112.853 176.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 43' ' ' LEU . 4.9 p-10 -139.58 153.99 70.92 Favored Pre-proline 0 N--CA 1.481 1.081 0 C-N-CA 122.482 0.313 . . . . 0.0 111.484 -171.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -67.66 -40.15 10.58 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.226 1.951 . . . . 0.0 112.793 176.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -61.25 -28.22 69.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.853 0.861 . . . . 0.0 113.116 -165.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.8 tp -68.43 -52.46 32.47 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.451 0.7 . . . . 0.0 112.496 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 59.4 t -70.11 -36.15 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 CA-C-O 121.43 0.633 . . . . 0.0 110.391 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mtp -74.53 -28.34 60.92 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.319 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 54' ' ' LYS . . . -64.48 -37.81 88.84 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.378 0.671 . . . . 0.0 110.995 177.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.517 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.9 t80 -54.52 -51.79 64.04 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.348 1.059 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -65.59 -43.63 89.11 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.929 -174.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -105.22 52.66 0.73 Allowed 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.481 -177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.6 OUTLIER -120.81 115.16 22.73 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.827 0.851 . . . . 0.0 110.645 175.685 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.94 79.1 9.33 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 169.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.225 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . 0.683 ' HB1' ' HB2' ' B' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -87.33 -41.8 13.36 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.642 0.777 . . . . 0.0 111.066 -175.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 21.6 p -93.09 -31.78 14.7 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.043 0.937 . . . . 0.0 111.589 -179.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.683 ' HB2' ' HB1' ' B' ' 1' ' ' ALA . 74.2 mmtt -72.46 104.31 3.76 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -73.27 101.9 3.52 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.577 ' HB ' HD11 ' A' ' 43' ' ' LEU . 28.4 m -149.33 153.2 37.1 Favored 'General case' 0 C--O 1.255 1.367 0 CA-C-O 122.288 1.042 . . . . 0.0 110.805 -167.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.509 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -142.96 150.05 39.18 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.554 -178.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.409 ' CZ ' ' HB3' ' A' ' 43' ' ' LEU . 2.2 mpt_? -86.54 157.54 19.73 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.467 ' HE2' ' CD1' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 170.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 16.8 p -54.14 101.9 0.05 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.626 0.77 . . . . 0.0 111.28 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 1.8 t -113.19 143.41 44.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.445 1.098 . . . . 0.0 111.262 -170.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -90.06 146.21 18.59 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.602 171.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 168.63 -175.37 43.22 Favored Glycine 0 C--N 1.343 0.945 0 N-CA-C 112.259 -0.336 . . . . 0.0 112.259 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 5.2 ttmp? -155.25 127.0 7.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.089 0.555 . . . . 0.0 110.54 -177.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.251 0 C-N-CA 124.912 1.285 . . . . 0.0 108.646 169.537 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.963 0 CA-C-O 119.762 -0.465 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -125.69 146.23 49.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.645 0.778 . . . . 0.0 109.67 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -99.78 82.3 2.58 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.407 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.7 m -90.59 143.57 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.64 0.776 . . . . 0.0 110.503 -176.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -139.61 138.18 35.96 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.643 0.777 . . . . 0.0 110.589 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.87 115.21 20.96 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 164.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 4.0 m -105.59 158.04 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.334 0.654 . . . . 0.0 111.576 -165.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -68.88 -56.14 8.86 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 123.773 0.67 . . . . 0.0 111.21 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.6 m -162.02 177.5 9.7 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.942 0.897 . . . . 0.0 110.225 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.2 mm -83.83 119.61 33.33 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 157.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.497 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.7 tmt_? -71.42 -62.94 1.23 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 175.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.497 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.4 mttt -128.09 160.16 32.85 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.68 0.792 . . . . 0.0 110.61 177.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -146.34 140.23 26.25 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.815 1.246 . . . . 0.0 107.788 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -163.89 -175.57 4.14 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.127 0.571 . . . . 0.0 110.03 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.7 p -139.26 124.02 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 170.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.434 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 79.0 ttt180 -123.14 106.04 10.43 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.215 1.406 . . . . 0.0 108.569 -173.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HE2' ' HG2' ' A' ' 16' ' ' ARG . 37.3 mtmt 65.95 25.49 11.07 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.758 1.223 . . . . 0.0 111.702 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.43 -13.94 66.43 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.603 -0.271 . . . . 0.0 113.0 -175.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm -84.76 110.96 19.18 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.242 0.617 . . . . 0.0 110.275 175.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.525 ' HB ' ' HB3' ' A' ' 39' ' ' GLU . 41.1 t -73.2 111.57 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -107.58 144.43 34.62 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.435 0.694 . . . . 0.0 110.864 -171.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -130.2 113.92 15.05 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.042 0.937 . . . . 0.0 110.255 -175.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 34.2 tp -74.56 93.83 2.56 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 166.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.478 HG21 ' NE2' ' A' ' 41' ' ' HIS . 59.6 t -87.36 116.12 29.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.514 0 C-N-CA 122.69 0.396 . . . . 0.0 110.406 -173.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -74.92 113.68 12.5 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.156 -179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 39.9 m95 -84.54 132.97 34.46 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.011 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -81.97 110.62 17.39 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 123.475 0.485 . . . . 0.0 109.886 -172.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 113.16 -16.96 22.29 Favored Glycine 0 N--CA 1.473 1.108 0 O-C-N 123.724 0.64 . . . . 0.0 111.681 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.523 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 20.6 m95 -107.83 130.54 22.67 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 123.963 0.905 . . . . 0.0 108.901 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 23.8 Cg_endo -59.96 154.61 49.43 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.444 2.096 . . . . 0.0 112.599 179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -51.22 -17.8 4.31 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 124.605 3.536 . . . . 0.0 116.166 -178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -79.96 -35.43 37.65 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.678 0.391 . . . . 0.0 111.138 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.446 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 41.9 m-85 -77.88 -11.36 59.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.468 0.707 . . . . 0.0 111.064 173.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 48.2 t -61.55 132.29 52.88 Favored 'General case' 0 C--N 1.358 0.972 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.1 p -127.72 164.14 22.78 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.075 0.55 . . . . 0.0 111.572 -170.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -100.16 116.59 32.54 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.39 1.076 . . . . 0.0 109.826 -172.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -125.41 153.37 72.29 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 168.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.59 -177.51 3.41 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.355 2.037 . . . . 0.0 114.214 -174.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.525 ' HB3' ' HB ' ' A' ' 20' ' ' VAL . 9.8 pt-20 -52.02 -31.43 29.78 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.267 1.827 . . . . 0.0 112.687 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.65 -45.99 92.02 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.721 1.208 . . . . 0.0 112.214 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.478 ' NE2' HG21 ' A' ' 24' ' ' VAL . 1.1 p-80 -75.52 -13.7 60.37 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -170.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.8 mm -66.87 104.84 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 175.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.569 HD12 ' HB ' ' B' ' 6' ' ' THR . 20.3 mt -90.39 -51.9 5.19 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.98 125.46 83.82 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 114.628 -1.169 . . . . 0.0 111.034 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -68.44 -37.52 13.14 Favored 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 122.901 2.401 . . . . 0.0 112.313 177.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.5 mmt180 -63.03 -21.76 66.38 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.764 0.826 . . . . 0.0 111.727 -177.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.1 -50.89 71.89 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.97 0.908 . . . . 0.0 111.618 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 46.8 t -80.24 -43.4 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 116.143 -0.481 . . . . 0.0 109.967 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.7 mtt -59.68 -45.38 92.26 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.301 1.04 . . . . 0.0 112.412 -175.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.25 -27.27 63.33 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.218 0.607 . . . . 0.0 111.143 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -69.21 -37.54 78.12 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.616 0.366 . . . . 0.0 110.938 172.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.0 mm-40 -60.42 -60.35 3.94 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.082 0.239 . . . . 0.0 111.265 -175.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 60.38 7.16 1.22 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 124.777 1.231 . . . . 0.0 113.636 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HG2' ' HB3' ' A' ' 52' ' ' GLU . 21.5 pttp -75.57 149.15 38.37 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 123.129 0.572 . . . . 0.0 111.127 -174.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -73.71 91.52 1.91 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.099 175.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.21 1.004 . . . . 0.0 110.865 -179.12 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 32.4 mmt180 -73.0 -46.23 53.41 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.378 0.671 . . . . 0.0 109.55 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 54.2 p -83.92 77.85 9.83 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.049 177.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -80.06 79.45 6.61 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.12 -179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -105.22 95.67 5.99 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.312 1.045 . . . . 0.0 108.869 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.569 ' HB ' HD12 ' A' ' 43' ' ' LEU . 10.8 p -78.99 119.91 22.81 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.691 -173.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.71 123.6 18.83 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.099 1.36 . . . . 0.0 108.523 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 41' ' ' HIS . 17.8 mtm-85 -93.55 119.95 33.22 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 119.1 -0.476 . . . . 0.0 109.934 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.406 ' HG3' ' CH2' ' A' ' 26' ' ' TRP . . . . . . . . 0 N--CA 1.489 1.478 0 CA-C-O 121.281 0.563 . . . . 0.0 110.88 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.2 t -173.82 -168.78 0.44 Allowed 'General case' 0 C--O 1.245 0.823 0 CA-C-N 114.115 -1.402 . . . . 0.0 108.226 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.6 p -63.49 -36.37 83.53 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.793 0.806 . . . . 0.0 108.886 160.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.44 131.34 1.22 Allowed Glycine 0 C--N 1.342 0.9 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.539 174.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.97 -35.81 90.04 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -130.43 166.56 20.22 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.633 1.173 . . . . 0.0 109.112 175.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 C-N-CA 123.501 0.721 . . . . 0.0 109.377 179.266 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.196 0 N-CA-C 112.282 -0.327 . . . . 0.0 112.282 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.42 0.77 4.08 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.492 0.717 . . . . 0.0 110.927 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -78.17 82.56 4.48 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.513 0.725 . . . . 0.0 110.721 -169.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.93 127.34 38.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 CA-C-O 121.041 0.448 . . . . 0.0 111.086 -177.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -122.26 162.98 20.44 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.838 0.855 . . . . 0.0 109.173 174.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.54 107.42 5.05 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.281 0.633 . . . . 0.0 110.491 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 9.6 m -75.93 154.09 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.382 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -80.52 -66.03 0.93 Allowed 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 163.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.4 m -164.64 -162.34 0.64 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.156 1.782 . . . . 0.0 107.421 174.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -85.38 137.22 21.23 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 164.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.567 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.8 tmt_? -88.9 -54.3 4.2 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 177.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -137.17 163.94 29.67 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.503 0.721 . . . . 0.0 110.618 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -151.49 143.54 23.92 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.144 0.977 . . . . 0.0 108.483 -173.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.0 ptm180 -164.42 168.0 18.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.683 0.793 . . . . 0.0 110.179 -176.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 20' ' ' VAL . 21.8 t -116.0 125.29 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -123.54 94.9 4.38 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.295 1.038 . . . . 0.0 108.701 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.1 mttt 57.58 39.15 27.9 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.322 1.049 . . . . 0.0 111.353 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.93 -18.27 57.02 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-N 114.943 -1.026 . . . . 0.0 113.371 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -90.9 108.08 19.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.979 0.512 . . . . 0.0 109.688 -177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 15' ' ' VAL . 42.6 t -80.66 109.41 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -176.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 55.8 mt-10 -97.14 155.42 16.83 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.603 0.716 . . . . 0.0 110.864 -176.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.473 ' HB3' HD12 ' A' ' 10' ' ' ILE . 75.2 m-85 -134.65 109.81 8.88 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.102 177.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.15 87.73 0.11 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 63.1 t -74.24 118.75 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.567 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 22.6 tptm -80.19 124.84 29.15 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 36.9 m95 -103.89 134.89 46.43 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.09 -38.79 66.27 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -165.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.36 14.68 60.43 Favored Glycine 0 N--CA 1.474 1.172 0 CA-C-N 116.365 -0.38 . . . . 0.0 113.535 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 69.2 m95 -135.47 135.67 22.7 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 123.658 0.783 . . . . 0.0 110.003 -176.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.99 164.75 21.05 Favored 'Trans proline' 0 CA--C 1.569 2.229 0 C-N-CA 122.971 2.447 . . . . 0.0 112.402 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.91 -13.47 27.32 Favored 'Trans proline' 0 C--N 1.388 2.623 0 C-N-CA 123.793 2.996 . . . . 0.0 114.754 -175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -69.8 -23.62 63.36 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.696 0.399 . . . . 0.0 111.866 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -103.58 3.08 34.21 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.727 0.811 . . . . 0.0 112.294 178.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.4 p -71.21 129.62 39.37 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 169.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 p -118.75 128.27 54.33 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.094 0.558 . . . . 0.0 112.228 -165.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -71.18 101.52 2.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.517 0.727 . . . . 0.0 109.324 173.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -133.31 134.91 24.55 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.502 0.721 . . . . 0.0 109.059 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 68.7 Cg_endo -68.91 167.39 23.41 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.839 2.359 . . . . 0.0 113.831 -173.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.08 -21.85 0.8 Allowed 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 125.329 1.451 . . . . 0.0 114.59 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -54.73 -44.72 73.79 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.591 1.156 . . . . 0.0 111.53 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -83.11 -5.64 59.19 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.224 -172.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.543 HG21 HG23 ' A' ' 48' ' ' VAL . 28.5 mm -80.28 121.19 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.625 HD11 ' HG3' ' B' ' 8' ' ' ARG . 5.5 mp -88.09 -47.98 8.08 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.044 0.538 . . . . 0.0 109.606 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -100.51 130.83 24.82 Favored Pre-proline 0 CA--C 1.549 0.928 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.581 -169.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.33 -35.29 24.45 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 122.699 2.266 . . . . 0.0 113.183 -177.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.582 ' HB2' HE21 ' B' ' 5' ' ' GLN . 56.5 mmm-85 -69.42 -16.15 63.44 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.179 0.592 . . . . 0.0 111.351 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 23.2 tp -64.53 -47.05 80.26 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.238 0.615 . . . . 0.0 110.461 173.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.543 HG23 HG21 ' A' ' 42' ' ' ILE . 67.5 t -73.58 -44.31 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.583 0.753 . . . . 0.0 110.577 176.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 22.4 mmt -67.1 -55.46 14.17 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.008 -171.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.26 -28.36 67.99 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.496 0.718 . . . . 0.0 112.558 -174.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -55.3 -49.92 70.9 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.915 0.886 . . . . 0.0 111.06 171.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -80.09 -31.29 39.27 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.748 0.819 . . . . 0.0 111.605 -176.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 49' ' ' MET . 8.9 pt-20 -124.13 90.67 3.3 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.916 . . . . 0.0 109.037 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -73.89 164.8 26.16 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 122.321 1.058 . . . . 0.0 113.41 -174.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.79 167.99 10.45 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-N 113.209 -1.814 . . . . 0.0 107.556 165.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 . . . . . 0 N--CA 1.486 1.367 0 C-N-CA 124.888 1.275 . . . . 0.0 110.992 171.843 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 121.125 0.488 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -149.67 143.18 25.33 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.779 0.832 . . . . 0.0 109.412 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.5 m -65.97 115.18 5.77 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.452 0.701 . . . . 0.0 110.435 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -135.51 -155.05 0.61 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.674 1.19 . . . . 0.0 109.586 -176.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.582 HE21 ' HB2' ' A' ' 46' ' ' ARG . 27.9 mp0 -62.39 107.11 0.85 Allowed 'General case' 0 C--N 1.353 0.742 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 161.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.1 m -140.51 155.17 46.73 Favored 'General case' 0 C--O 1.25 1.084 0 C-N-CA 122.927 0.491 . . . . 0.0 110.122 -171.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.73 133.78 22.7 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.324 0.649 . . . . 0.0 111.365 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.625 ' HG3' HD11 ' A' ' 43' ' ' LEU . 94.7 mtt180 -79.38 118.42 21.27 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.844 0.858 . . . . 0.0 110.125 178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.454 0 CA-C-N 118.884 0.765 . . . . 0.0 110.561 174.728 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 40.1 t -60.92 139.34 58.03 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 124.607 1.192 . . . . 0.0 109.694 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 22.3 m -61.1 -30.67 70.49 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.015 0.526 . . . . 0.0 110.482 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.46 32.12 65.09 Favored Glycine 0 C--N 1.352 1.454 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.113 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.31 76.66 1.45 Allowed Glycine 0 C--N 1.351 1.367 0 O-C-N 123.842 0.378 . . . . 0.0 112.169 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -168.69 146.8 4.03 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.435 1.094 . . . . 0.0 109.329 -178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.203 0 C-N-CA 123.577 0.751 . . . . 0.0 110.545 175.155 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 111.894 -0.483 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HB3' ' HG3' ' B' ' 8' ' ' ARG . 2.7 mp0 -91.5 125.14 36.14 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.698 0.799 . . . . 0.0 109.313 -177.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -78.47 82.06 4.77 Favored 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.448 0.699 . . . . 0.0 109.696 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.463 HG11 HH11 ' B' ' 8' ' ' ARG . 35.2 m -97.06 127.58 49.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.963 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -130.15 148.53 52.0 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 124.088 0.955 . . . . 0.0 108.509 177.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.85 117.72 9.35 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.022 0.529 . . . . 0.0 109.627 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.447 HG12 ' CE3' ' A' ' 26' ' ' TRP . 11.2 m -99.64 150.79 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 123.171 0.588 . . . . 0.0 110.267 -176.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.575 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 40.0 tt0 -73.62 -72.38 0.27 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.5 m -162.07 -176.42 5.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.141 1.377 . . . . 0.0 108.114 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.479 HD12 ' HB3' ' A' ' 22' ' ' TYR . 33.7 mm -71.3 124.49 27.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 166.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.492 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.6 tmt_? -76.97 -57.21 3.98 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 174.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.2 mttm -134.55 160.29 38.51 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.063 0.945 . . . . 0.0 110.421 177.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -145.61 134.49 22.47 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.91 0.884 . . . . 0.0 109.103 -166.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.3 ptt180 -167.24 176.58 6.66 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.213 0.605 . . . . 0.0 110.602 -178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -128.47 117.15 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 168.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -112.11 101.68 9.93 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.766 0.826 . . . . 0.0 109.299 179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.5 tptp 52.99 53.12 12.54 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.61 1.164 . . . . 0.0 112.229 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.67 -17.06 58.68 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-N 115.324 -0.853 . . . . 0.0 114.066 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 mttp -91.82 118.75 30.99 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 174.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 98.3 t -83.49 102.49 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -105.93 138.59 41.86 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 122.979 0.512 . . . . 0.0 110.514 -167.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.479 ' HB3' HD12 ' A' ' 10' ' ' ILE . 22.2 m-85 -126.14 113.22 16.76 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.725 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.6 tp -64.62 100.63 0.39 Allowed 'General case' 0 C--O 1.21 -0.975 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 164.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.48 HG21 ' CE1' ' A' ' 41' ' ' HIS . 95.3 t -100.69 129.22 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -87.27 109.89 19.82 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 177.125 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.447 ' CE3' HG12 ' A' ' 7' ' ' VAL . 27.1 m95 -83.64 106.79 15.64 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.575 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 63.4 pttt -69.26 -22.43 63.84 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -168.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.78 -36.89 92.83 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.561 0.538 . . . . 0.0 112.389 175.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -101.65 164.53 15.72 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.454 1.102 . . . . 0.0 109.48 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -70.69 152.64 64.68 Favored 'Trans proline' 0 CA--C 1.564 2.006 0 C-N-CA 121.612 1.541 . . . . 0.0 111.351 173.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -59.17 -8.82 7.01 Favored 'Trans proline' 0 C--N 1.388 2.639 0 C-N-CA 124.089 3.193 . . . . 0.0 115.775 -173.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -70.2 -12.72 61.79 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.05 0.386 . . . . 0.0 111.579 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -105.46 18.22 22.59 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.096 0.959 . . . . 0.0 111.286 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -68.76 116.98 9.88 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -109.81 140.48 43.69 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.293 0.637 . . . . 0.0 111.114 -174.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -75.46 87.33 2.61 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -102.59 127.94 29.2 Favored Pre-proline 0 CA--C 1.551 1.017 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.255 -179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 57.3 Cg_endo -66.66 159.31 51.68 Favored 'Trans proline' 0 C--N 1.383 2.343 0 C-N-CA 123.235 2.623 . . . . 0.0 112.545 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -58.95 -11.95 3.97 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -167.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -58.18 -33.57 69.39 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.307 1.043 . . . . 0.0 110.696 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.557 ' ND1' ' HB1' ' B' ' 7' ' ' ALA . 0.3 OUTLIER -79.76 -13.51 59.39 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -174.348 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.7 mm -72.46 122.1 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.914 0.886 . . . . 0.0 110.515 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.7 mt -106.1 -0.92 24.34 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.773 0.429 . . . . 0.0 111.643 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -145.43 128.0 8.1 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.199 0.6 . . . . 0.0 109.427 -172.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -62.66 -43.72 20.18 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.627 2.218 . . . . 0.0 112.527 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.532 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 58.7 mtt180 -70.41 -15.48 62.84 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.833 0.853 . . . . 0.0 111.648 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 13.0 tp -53.63 -46.03 70.35 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.326 0.65 . . . . 0.0 110.213 168.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.3 t -89.82 -39.44 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 124.044 0.938 . . . . 0.0 111.317 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.532 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 20.2 mmt -71.68 -45.06 63.08 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.684 0.794 . . . . 0.0 111.874 -171.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.92 -26.91 65.33 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.506 0.722 . . . . 0.0 111.867 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -54.56 -44.2 72.7 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.123 0.569 . . . . 0.0 110.883 174.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -99.3 -13.66 19.56 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 122.841 0.456 . . . . 0.0 111.671 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 61.01 63.19 1.3 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.292 1.037 . . . . 0.0 111.868 -178.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.34 -2.47 12.63 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.22 0.608 . . . . 0.0 112.403 177.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -80.37 85.19 5.88 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 174.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 . . . . . 0 C--O 1.251 1.149 0 CA-C-N 114.885 -1.052 . . . . 0.0 108.545 -178.271 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -98.49 26.17 5.75 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.011 0.924 . . . . 0.0 110.026 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.1 p -62.4 93.57 0.05 Allowed 'General case' 0 C--N 1.356 0.888 0 C-N-CA 124.027 0.931 . . . . 0.0 110.277 178.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -139.6 77.02 1.59 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.805 -174.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.436 ' O ' HG22 ' A' ' 7' ' ' VAL . 19.4 mp0 -63.12 117.24 6.24 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 171.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.4 m -121.61 150.09 42.21 Favored 'General case' 0 C--O 1.249 1.051 0 C-N-CA 123.832 0.853 . . . . 0.0 109.425 -174.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.557 ' HB1' ' ND1' ' A' ' 41' ' ' HIS . . . -156.34 147.0 21.77 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.279 0.632 . . . . 0.0 111.136 -175.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 2' ' ' GLU . 2.2 mpt_? -83.84 159.69 21.33 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.478 0.711 . . . . 0.0 110.127 174.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 121.008 0.432 . . . . 0.0 110.758 168.362 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 15.2 m -58.52 100.95 0.07 Allowed 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.799 173.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 26.1 m -62.73 95.02 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.006 0.523 . . . . 0.0 110.469 -177.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.64 -12.25 59.67 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 115.412 -0.813 . . . . 0.0 113.808 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 75.03 68.48 1.54 Allowed Glycine 0 C--N 1.349 1.29 0 N-CA-C 112.03 -0.428 . . . . 0.0 112.03 -176.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -92.06 -30.37 16.06 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.629 0.772 . . . . 0.0 110.988 -177.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.188 0 C-N-CA 123.455 0.702 . . . . 0.0 109.421 178.229 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.908 0 CA-C-O 120.198 -0.223 . . . . 0.0 112.888 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -97.39 153.93 17.78 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.486 0.714 . . . . 0.0 111.277 -176.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.518 ' HB2' ' HB3' ' B' ' 9' ' ' M3L . 45.4 mt-30 -108.88 94.0 4.82 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.113 0.965 . . . . 0.0 110.433 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.18 119.53 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 168.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -118.66 157.31 27.68 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.675 0.79 . . . . 0.0 109.625 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.51 123.86 21.99 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.054 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.598 HG21 HD13 ' A' ' 47' ' ' LEU . 12.4 m -97.1 153.28 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 C-N-CA 123.696 0.798 . . . . 0.0 111.097 -173.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -81.95 -78.5 0.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 163.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.6 m -161.22 -173.75 4.0 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.997 1.319 . . . . 0.0 107.759 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.766 HD12 ' HB3' ' A' ' 22' ' ' TYR . 43.0 mm -81.09 115.72 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 169.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -57.68 6.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.123 0.969 . . . . 0.0 109.382 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.431 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.5 mttm -136.44 162.45 33.02 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.154 0.982 . . . . 0.0 110.008 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -146.58 141.09 26.6 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.706 0.803 . . . . 0.0 108.89 -174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -162.89 -176.57 4.99 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.687 1.195 . . . . 0.0 108.966 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 23.9 t -128.21 144.95 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -147.16 116.95 7.15 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt 65.73 28.74 10.95 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.563 1.145 . . . . 0.0 110.747 175.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.1 -12.97 58.76 Favored Glycine 0 C--N 1.352 1.455 0 CA-C-N 115.485 -0.779 . . . . 0.0 113.011 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.5 mmtm -95.79 112.37 24.11 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.284 0.634 . . . . 0.0 109.639 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.0 t -70.41 119.95 17.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.451 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -94.0 142.35 27.49 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.514 0.725 . . . . 0.0 109.658 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.766 ' HB3' HD12 ' A' ' 10' ' ' ILE . 97.7 m-85 -130.4 108.08 9.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.284 178.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.431 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 44.1 tp -65.96 84.51 0.08 Allowed 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.03 109.54 2.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 -176.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -77.62 124.97 28.62 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 172.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m95 -97.84 136.53 38.03 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 28' ' ' GLY . 0.1 OUTLIER -65.25 -31.12 72.11 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -168.032 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.51 ' N ' ' HD3' ' A' ' 27' ' ' LYS . . . -97.78 2.56 60.33 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.946 -176.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.419 ' HB3' ' HB2' ' A' ' 33' ' ' TYR . 60.4 m95 -124.58 133.36 24.69 Favored Pre-proline 0 N--CA 1.471 0.61 0 C-N-CA 123.576 0.75 . . . . 0.0 109.647 -172.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -61.12 165.18 12.94 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.028 2.485 . . . . 0.0 112.277 174.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -57.53 -23.36 56.01 Favored 'Trans proline' 0 C--N 1.39 2.745 0 C-N-CA 123.254 2.636 . . . . 0.0 114.154 -176.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -13.33 61.35 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.13 0.572 . . . . 0.0 112.495 177.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 81.9 m-85 -113.86 1.39 14.76 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.585 0.754 . . . . 0.0 112.306 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.9 p -69.14 130.29 42.27 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 171.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.2 p -117.78 138.57 51.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.084 0.554 . . . . 0.0 111.404 -169.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.7 m95 -72.87 84.66 1.23 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.638 0.775 . . . . 0.0 109.087 176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -96.95 116.33 66.03 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.445 0.698 . . . . 0.0 109.131 178.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.72 176.2 4.55 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.464 2.109 . . . . 0.0 113.882 -175.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -50.41 -36.31 32.36 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.96 1.704 . . . . 0.0 113.212 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -60.84 -34.88 75.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.404 1.082 . . . . 0.0 112.382 -178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -83.37 -23.64 32.35 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.354 0.662 . . . . 0.0 112.258 -173.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.586 HG21 HG23 ' A' ' 48' ' ' VAL . 27.0 mm -71.93 108.45 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.592 HD11 ' HB ' ' B' ' 6' ' ' THR . 4.6 pp -99.46 -24.5 14.76 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-N 117.667 0.212 . . . . 0.0 111.505 -173.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -104.11 120.54 50.64 Favored Pre-proline 0 N--CA 1.475 0.801 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -64.83 -20.12 64.53 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.3 2.0 . . . . 0.0 111.583 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -61.19 -20.51 62.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.835 1.254 . . . . 0.0 112.222 177.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.598 HD13 HG21 ' A' ' 7' ' ' VAL . 16.7 tp -71.72 -47.49 53.54 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.056 0.542 . . . . 0.0 111.164 178.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.586 HG23 HG21 ' A' ' 42' ' ' ILE . 78.8 t -77.67 -37.72 24.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 123.346 0.658 . . . . 0.0 110.682 179.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.6 mmt -67.08 -41.06 87.01 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.14 -178.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.77 -30.91 70.31 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.278 0.561 . . . . 0.0 111.493 178.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -71.8 -53.24 13.97 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.231 1.013 . . . . 0.0 110.937 177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.11 -56.14 3.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.795 0.438 . . . . 0.0 111.236 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 64.85 16.58 10.56 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.608 1.163 . . . . 0.0 111.933 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.51 131.62 40.2 Favored 'General case' 0 C--N 1.353 0.718 0 N-CA-C 109.873 -0.418 . . . . 0.0 109.873 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -95.66 15.79 19.03 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.228 1.011 . . . . 0.0 110.325 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 . . . . . 0 C--O 1.249 1.057 0 C-N-CA 124.41 1.084 . . . . 0.0 109.248 174.62 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 59.92 17.54 6.67 Favored 'General case' 0 N--CA 1.496 1.874 0 C-N-CA 125.223 1.409 . . . . 0.0 112.342 -173.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 39.8 p -99.46 131.16 45.65 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.35 1.06 . . . . 0.0 108.246 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.79 -176.17 5.32 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.87 0.468 . . . . 0.0 110.899 -171.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.508 HE21 ' HA ' ' A' ' 47' ' ' LEU . 49.0 tt0 -147.58 104.19 3.6 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -176.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.592 ' HB ' HD11 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -147.85 152.6 37.9 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.434 0.635 . . . . 0.0 111.692 -172.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.88 160.62 37.11 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 124.392 1.077 . . . . 0.0 109.494 169.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 -97.88 151.04 20.65 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 124.246 1.019 . . . . 0.0 109.198 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.518 ' HB3' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 121.249 0.547 . . . . 0.0 110.97 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 4.8 p -68.71 82.39 0.28 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.639 175.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.2 m -75.58 99.91 4.42 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.802 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 167.88 -142.64 7.63 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.849 -176.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -178.41 154.22 14.24 Favored Glycine 0 C--N 1.35 1.321 0 CA-C-N 117.341 0.571 . . . . 0.0 113.662 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -78.28 144.16 36.39 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 109.989 176.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.09 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 174.549 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.147 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -81.75 66.46 7.32 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.59 0.756 . . . . 0.0 111.12 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -92.58 107.64 19.37 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 115.116 -0.947 . . . . 0.0 108.827 175.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 m -96.79 140.88 16.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -130.26 142.03 50.58 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.264 0.626 . . . . 0.0 109.461 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 126.91 30.68 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.729 169.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.0 m -105.99 154.66 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.022 0.439 . . . . 0.0 111.565 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.448 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 42.9 tt0 -78.33 -63.57 1.37 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.946 172.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.6 m -165.56 173.39 10.97 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.681 1.192 . . . . 0.0 110.073 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.457 HD12 ' HB3' ' A' ' 22' ' ' TYR . 41.3 mm -85.11 126.59 40.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 162.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -52.79 6.26 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.99 170.04 16.7 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.829 0.852 . . . . 0.0 110.17 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -156.61 145.63 20.29 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.131 0.573 . . . . 0.0 110.094 -173.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -159.93 169.88 22.55 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.896 0.878 . . . . 0.0 109.208 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.41 115.91 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 166.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -137.0 126.45 25.04 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -174.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm 65.46 24.95 11.91 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.016 0.913 . . . . 0.0 110.374 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.89 -9.05 47.31 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.282 -0.872 . . . . 0.0 113.18 -174.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -93.92 111.43 23.14 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 123.988 0.915 . . . . 0.0 108.918 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.403 ' HB ' ' HG3' ' A' ' 39' ' ' GLU . 23.6 t -77.17 106.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -98.4 138.6 35.4 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 123.96 0.904 . . . . 0.0 110.288 -173.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 59.0 m-85 -122.61 117.25 25.39 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 tp -71.07 81.77 0.69 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.552 HG21 ' NE2' ' A' ' 41' ' ' HIS . 85.6 t -75.88 110.35 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.009 -169.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -75.39 107.44 7.51 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 52.7 m95 -75.78 147.83 38.93 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.093 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 0.6 OUTLIER -64.46 -54.49 31.79 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.164 0.586 . . . . 0.0 112.146 -169.192 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.81 13.19 64.0 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 116.207 -0.451 . . . . 0.0 113.796 -175.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.642 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 70.5 m95 -117.78 141.43 29.08 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 123.526 0.73 . . . . 0.0 109.772 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.412 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 41.3 Cg_endo -64.59 160.83 38.06 Favored 'Trans proline' 0 CA--C 1.563 1.932 0 C-N-CA 122.904 2.403 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.16 -20.37 46.13 Favored 'Trans proline' 0 C--N 1.389 2.659 0 C-N-CA 123.604 2.869 . . . . 0.0 115.184 -177.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 pttm -74.22 -19.81 60.39 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.412 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 39.3 m-85 -96.22 5.72 50.4 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.793 0.837 . . . . 0.0 111.897 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.9 p -68.36 117.85 10.68 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 171.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.7 p -106.06 144.29 32.99 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.503 0.721 . . . . 0.0 110.797 -173.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -74.04 80.03 1.71 Allowed 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.051 0.929 . . . . 0.0 109.889 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -83.82 120.79 75.59 Favored Pre-proline 0 C--O 1.242 0.682 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.953 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -66.35 155.63 69.04 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 121.933 1.755 . . . . 0.0 111.428 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.403 ' HG3' ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -49.89 -19.89 0.78 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.686 1.595 . . . . 0.0 114.849 -177.332 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -55.35 -32.72 62.78 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.461 1.104 . . . . 0.0 112.854 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.604 ' CD2' ' HB1' ' B' ' 7' ' ' ALA . 2.8 p-80 -82.07 -12.22 58.37 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 31.9 mm -64.89 120.63 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.935 0.894 . . . . 0.0 110.335 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.465 HD12 HG22 ' B' ' 6' ' ' THR . 38.0 mt -110.02 2.23 19.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.756 0.423 . . . . 0.0 110.985 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -150.89 127.19 5.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.328 0.651 . . . . 0.0 110.622 -174.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.32 -37.33 40.74 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.943 2.428 . . . . 0.0 112.199 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -64.81 -18.49 65.15 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.452 0.701 . . . . 0.0 111.478 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 21.1 tp -65.87 -52.59 48.98 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.224 0.61 . . . . 0.0 111.314 174.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 38.2 t -72.05 -37.64 60.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-O 121.567 0.699 . . . . 0.0 110.075 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.6 mmt -70.98 -29.24 65.15 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.847 -178.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -30.56 70.76 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.007 0.432 . . . . 0.0 110.692 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -76.07 -56.29 4.79 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.543 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -80.45 -54.47 5.66 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.079 0.551 . . . . 0.0 110.934 -171.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -88.96 58.16 4.45 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -81.87 124.42 29.69 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.948 -170.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -79.9 91.75 5.43 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.317 0.647 . . . . 0.0 109.711 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.798 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 51.6 22.54 1.61 Allowed 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 126.333 1.853 . . . . 0.0 113.596 177.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 37.1 p -75.56 76.03 2.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.713 0.805 . . . . 0.0 112.455 -169.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -86.85 -29.94 21.84 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.862 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.43 97.09 0.09 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.265 169.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.465 HG22 HD12 ' A' ' 43' ' ' LEU . 13.0 m -117.87 150.99 38.27 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.913 -178.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.604 ' HB1' ' CD2' ' A' ' 41' ' ' HIS . . . -151.56 129.53 11.77 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.976 -175.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 -68.78 171.25 8.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.838 0.855 . . . . 0.0 110.792 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.689 0 CA-C-O 120.711 0.291 . . . . 0.0 111.394 167.073 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 43.4 m -60.76 89.95 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.058 0.943 . . . . 0.0 111.102 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 17.9 m -147.48 141.14 25.58 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.58 -2.55 57.37 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 -171.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 85.63 -118.97 4.95 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 111.948 -0.461 . . . . 0.0 111.948 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm 61.21 16.74 7.51 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.947 1.299 . . . . 0.0 112.607 -177.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 C-N-CA 124.267 1.027 . . . . 0.0 109.244 -176.648 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 65.94 98.92 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 125.01 1.324 . . . . 0.0 110.575 -175.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.44 ' HB3' ' HE1' ' A' ' 5' ' ' PHE . 1.8 mp0 -105.41 105.66 15.8 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.736 0.815 . . . . 0.0 109.714 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.6 m -105.35 130.37 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 172.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.44 ' HE1' ' HB3' ' A' ' 3' ' ' GLN . 37.3 m-85 -130.18 164.05 25.32 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.545 0.738 . . . . 0.0 109.747 179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -66.35 115.05 5.87 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.601 HG21 HD13 ' A' ' 47' ' ' LEU . 14.2 m -79.94 156.06 4.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 123.085 0.554 . . . . 0.0 110.242 179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.586 ' HA ' ' HE3' ' A' ' 27' ' ' LYS . 37.1 tt0 -85.75 -67.93 0.77 Allowed 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 161.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 m -164.99 -167.79 1.29 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.157 1.383 . . . . 0.0 108.142 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.477 HD12 ' HB3' ' A' ' 22' ' ' TYR . 46.4 mm -91.93 133.2 34.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 163.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -88.22 -54.8 4.03 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.444 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 97.7 mttt -136.83 176.87 8.32 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.718 0.807 . . . . 0.0 110.583 -178.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -153.62 144.7 22.88 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -170.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -160.18 -175.04 4.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.923 0.889 . . . . 0.0 109.272 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.9 p -142.81 132.5 22.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 173.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -134.27 105.4 6.61 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.134 0.974 . . . . 0.0 109.101 -172.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp 56.6 39.52 29.79 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.79 1.236 . . . . 0.0 111.566 -178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.92 -18.27 56.26 Favored Glycine 0 C--N 1.346 1.115 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.811 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -87.13 110.57 20.22 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 117.077 0.438 . . . . 0.0 110.764 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -75.06 110.15 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.603 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 34.8 mt-10 -101.11 146.69 27.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.472 0.709 . . . . 0.0 110.538 -173.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.9 m-85 -127.16 119.25 26.02 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.444 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 35.3 tp -70.46 82.84 0.58 Allowed 'General case' 0 C--N 1.347 0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 175.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -65.97 107.19 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -176.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -77.58 118.94 20.47 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 40.1 m95 -92.61 149.43 21.35 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.586 ' HE3' ' HA ' ' A' ' 8' ' ' GLU . 3.5 tppp? -61.13 -51.61 68.35 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.189 0.996 . . . . 0.0 112.991 -167.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.93 6.53 76.63 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.61 -0.328 . . . . 0.0 113.576 -177.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 36.1 m95 -121.46 132.52 24.2 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.806 0.843 . . . . 0.0 109.632 -169.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 47.3 Cg_endo -66.03 165.96 22.32 Favored 'Trans proline' 0 C--N 1.377 2.072 0 C-N-CA 122.974 2.449 . . . . 0.0 112.78 -179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.0 0.44 2.57 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 123.46 2.773 . . . . 0.0 115.207 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -91.88 -31.61 15.62 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 118.233 0.469 . . . . 0.0 111.077 168.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.448 ' HD1' ' HG2' ' A' ' 30' ' ' PRO . 49.4 m-85 -86.08 -1.75 57.68 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.461 0.705 . . . . 0.0 111.343 175.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.1 p -70.9 141.09 51.18 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 168.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.68 141.54 51.58 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.818 0.447 . . . . 0.0 111.935 -170.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -76.35 85.29 3.12 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.202 1.001 . . . . 0.0 110.282 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -95.22 114.63 64.2 Favored Pre-proline 0 CA--C 1.546 0.822 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.513 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.603 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 71.9 Cg_exo -53.63 172.35 0.25 Allowed 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 123.653 2.902 . . . . 0.0 114.845 176.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -32.26 66.29 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 114.81 -1.086 . . . . 0.0 112.857 -176.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -70.72 -29.27 65.5 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.897 0.479 . . . . 0.0 111.352 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -77.22 -33.03 56.25 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.231 0.612 . . . . 0.0 110.624 177.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.614 HG23 HD23 ' A' ' 47' ' ' LEU . 36.0 mm -71.79 116.9 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 172.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.1 15.39 23.32 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 118.062 0.392 . . . . 0.0 111.565 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -134.37 127.97 19.07 Favored Pre-proline 0 N--CA 1.476 0.829 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.24 -56.53 1.54 Allowed 'Trans proline' 0 C--N 1.378 2.094 0 C-N-CA 122.594 2.196 . . . . 0.0 112.183 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.514 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 84.6 mtt85 -69.54 -15.27 63.2 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.75 0.82 . . . . 0.0 112.993 -170.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 42' ' ' ILE . 23.8 tp -56.94 -44.36 82.45 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-O 121.121 0.486 . . . . 0.0 110.126 169.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.563 HG23 HG21 ' A' ' 42' ' ' ILE . 53.8 t -84.25 -48.85 16.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.469 1.107 . . . . 0.0 111.122 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.514 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 23.7 mmt -62.41 -37.97 87.86 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.214 -170.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.94 -45.43 85.81 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.818 0.447 . . . . 0.0 111.137 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -54.41 -50.73 66.9 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.088 0.955 . . . . 0.0 111.445 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -84.45 -6.14 59.35 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 63.23 27.45 15.55 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.141 0.976 . . . . 0.0 110.881 -173.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -78.93 84.62 4.95 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.171 0.988 . . . . 0.0 110.454 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -92.56 -17.06 24.92 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.76 0.824 . . . . 0.0 110.029 169.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 CA--C 1.562 1.413 0 C-N-CA 124.518 1.127 . . . . 0.0 110.834 175.9 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 37.98 39.34 0.24 Allowed 'General case' 0 N--CA 1.505 2.307 0 C-N-CA 125.792 1.637 . . . . 0.0 113.273 -174.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.3 m -88.48 41.28 1.01 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.975 0.91 . . . . 0.0 110.029 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -73.94 -16.78 61.08 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.385 0.674 . . . . 0.0 109.383 174.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -57.98 104.5 0.2 Allowed 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 165.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 6.9 p -141.85 159.61 41.87 Favored 'General case' 0 C--O 1.256 1.445 0 C-N-CA 123.902 0.881 . . . . 0.0 110.258 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.56 141.79 30.83 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.432 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -88.93 135.83 33.33 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.399 0.68 . . . . 0.0 109.406 179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.79 0 O-C-N 123.085 0.241 . . . . 0.0 110.522 176.861 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 48.0 t -50.14 109.79 0.33 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.863 1.265 . . . . 0.0 111.508 179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 51.2 p -75.3 -3.32 32.67 Favored 'General case' 0 CA--C 1.548 0.88 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.861 -176.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.94 103.74 0.9 Allowed Glycine 0 C--N 1.347 1.17 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 170.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.83 -48.0 51.67 Favored Glycine 0 C--N 1.351 1.406 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 -177.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.96 173.35 16.68 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.368 0.667 . . . . 0.0 110.621 176.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.314 0 C-N-CA 124.858 1.263 . . . . 0.0 111.104 178.435 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -66.77 -38.15 86.02 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.525 0.73 . . . . 0.0 111.379 -175.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -117.42 105.59 12.3 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.543 0.737 . . . . 0.0 110.176 -174.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.468 HG12 ' HG2' ' B' ' 8' ' ' ARG . 6.4 m -131.1 98.41 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.754 1.222 . . . . 0.0 109.426 178.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -112.16 156.29 22.54 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.133 0.573 . . . . 0.0 111.372 -172.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.25 139.67 38.89 Favored 'General case' 0 C--O 1.242 0.684 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.018 169.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.4 HG12 ' CE3' ' A' ' 26' ' ' TRP . 10.1 m -120.23 157.11 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.68 0.792 . . . . 0.0 110.646 -171.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 5.9 tp10 -61.5 -65.21 0.73 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 164.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.3 m -167.01 -179.52 4.69 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.479 1.112 . . . . 0.0 109.412 -179.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.8 mm -75.19 106.33 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 161.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.546 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -63.07 -54.01 44.65 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.366 0.667 . . . . 0.0 110.191 -178.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -138.62 172.96 12.11 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.408 0.683 . . . . 0.0 110.389 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -153.39 127.17 8.84 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.852 0.861 . . . . 0.0 108.779 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.87 178.43 9.16 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.357 0.663 . . . . 0.0 110.373 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.62 116.05 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.759 0.824 . . . . 0.0 108.962 172.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -131.53 121.65 24.81 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -175.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.6 tptt 65.62 26.41 11.57 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.518 1.127 . . . . 0.0 110.672 179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.66 -13.39 58.7 Favored Glycine 0 C--N 1.349 1.297 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.821 -176.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -86.95 110.55 20.1 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 123.261 0.625 . . . . 0.0 109.483 -179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.9 t -77.79 107.24 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -104.05 136.14 44.25 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.901 0.481 . . . . 0.0 110.275 -172.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -113.92 121.06 42.79 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.546 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.9 tp -71.36 113.93 8.91 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 168.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG21 ' CE1' ' A' ' 41' ' ' HIS . 13.1 t -100.5 108.14 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -170.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -77.3 110.39 11.99 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.238 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 34' ' ' SER . 38.8 m95 -87.18 133.31 33.66 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 8' ' ' GLU . 2.9 tppp? -80.34 -50.08 10.65 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.346 0.658 . . . . 0.0 111.543 -172.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.75 -4.19 87.84 Favored Glycine 0 CA--C 1.54 1.65 0 N-CA-C 114.03 0.372 . . . . 0.0 114.03 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 54.5 m95 -120.28 149.43 49.53 Favored Pre-proline 0 N--CA 1.48 1.036 0 C-N-CA 124.247 1.019 . . . . 0.0 109.956 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.06 150.97 87.25 Favored 'Trans proline' 0 C--N 1.382 2.298 0 C-N-CA 122.685 2.257 . . . . 0.0 112.601 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -54.75 -30.39 66.87 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 124.507 3.472 . . . . 0.0 116.013 -167.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -73.02 -17.02 61.48 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -78.97 -1.36 34.98 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.49 0.716 . . . . 0.0 111.909 174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.426 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 57.0 m -67.12 116.51 8.0 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 174.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 p -97.97 141.24 31.18 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.138 0.975 . . . . 0.0 111.139 -173.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -78.96 105.6 10.4 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 167.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.427 ' HB3' ' CD2' ' A' ' 41' ' ' HIS . 13.1 mm-40 -121.34 126.99 26.33 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.236 1.014 . . . . 0.0 109.402 -173.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -57.26 142.43 94.71 Favored 'Trans proline' 0 C--N 1.38 2.191 0 C-N-CA 123.565 2.843 . . . . 0.0 111.87 -178.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -54.4 -24.36 19.45 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -164.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.88 -24.81 67.99 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 124.265 1.026 . . . . 0.0 112.003 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.44 ' CE1' HG21 ' A' ' 24' ' ' VAL . 2.7 p80 -70.43 -19.49 62.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.458 0.703 . . . . 0.0 112.457 -174.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.605 HG23 HD23 ' A' ' 47' ' ' LEU . 36.8 mm -71.44 134.08 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 123.334 0.654 . . . . 0.0 109.432 -178.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.496 HD12 ' HB ' ' B' ' 6' ' ' THR . 31.7 mt -100.15 5.12 44.81 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.154 0.582 . . . . 0.0 111.534 -174.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.568 ' H ' HG22 ' A' ' 42' ' ' ILE . 32.5 t70 -151.13 125.34 4.48 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 122.757 0.423 . . . . 0.0 111.379 -174.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -64.55 -37.05 39.77 Favored 'Trans proline' 0 C--N 1.376 2.024 0 C-N-CA 122.526 2.151 . . . . 0.0 112.699 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.448 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 88.8 mtt-85 -68.27 -15.12 63.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.487 0.715 . . . . 0.0 111.989 -175.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.605 HD23 HG23 ' A' ' 42' ' ' ILE . 12.0 tp -69.06 -52.51 27.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.384 0.674 . . . . 0.0 110.598 173.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.18 -33.43 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 121.594 0.711 . . . . 0.0 109.609 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.448 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 97.7 mmm -73.74 -29.38 62.2 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.971 176.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 54' ' ' LYS . . . -67.3 -29.68 69.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.563 0.345 . . . . 0.0 110.347 174.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -71.7 -57.72 4.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.39 0.676 . . . . 0.0 110.709 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -79.23 -24.47 43.02 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.31 -168.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -107.1 16.34 24.25 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.248 0.619 . . . . 0.0 111.519 -178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 34.7 ttmt -73.12 168.49 18.98 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 66.08 18.73 11.07 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 124.464 1.106 . . . . 0.0 110.62 -173.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 . . . . . 0 C--O 1.246 0.893 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -176.324 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' B' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -66.18 -51.4 58.16 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.919 0.888 . . . . 0.0 110.91 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 10.2 m -109.52 67.99 0.66 Allowed 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.759 0.79 . . . . 0.0 109.092 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.533 ' HB2' ' HB1' ' B' ' 1' ' ' ALA . 20.8 tptm -94.29 69.68 3.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 173.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 47' ' ' LEU . 8.7 mm100 -106.01 109.66 21.67 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.14 -175.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.496 ' HB ' HD12 ' A' ' 43' ' ' LEU . 19.4 p -74.66 128.74 36.29 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.475 0.71 . . . . 0.0 111.119 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.45 134.85 36.29 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.468 ' HG2' HG12 ' A' ' 4' ' ' VAL . 97.0 mtt180 -74.69 171.62 13.58 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.822 0.82 . . . . 0.0 112.503 -177.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.486 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.545 166.55 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 76.7 p -168.54 160.74 11.18 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.784 -175.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 14.9 t -106.32 4.09 28.26 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.699 1.2 . . . . 0.0 109.987 167.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 174.95 168.26 35.34 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 109.98 -1.248 . . . . 0.0 109.98 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -133.23 21.2 4.13 Favored Glycine 0 N--CA 1.478 1.452 0 CA-C-N 118.29 1.045 . . . . 0.0 114.204 -174.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -121.36 115.43 22.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.922 0.489 . . . . 0.0 110.676 -178.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.453 0.701 . . . . 0.0 110.171 178.35 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.878 0 N-CA-C 112.288 -0.325 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.415 ' HA ' ' HA ' ' B' ' 11' ' ' THR . 12.2 pt-20 -70.77 -179.61 2.27 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.547 0.739 . . . . 0.0 111.454 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -154.9 118.48 4.54 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -177.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.7 m -111.49 148.2 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.043 0.937 . . . . 0.0 110.58 178.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -146.78 164.07 33.97 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.816 0.847 . . . . 0.0 111.258 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.68 126.01 28.59 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.071 173.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 47' ' ' LEU . 35.8 m -104.95 151.45 7.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 124.051 0.94 . . . . 0.0 111.025 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -86.17 -70.52 0.59 Allowed 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 168.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 72.8 m -162.4 -177.63 5.78 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 125.176 1.39 . . . . 0.0 108.544 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.6 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.1 mm -76.5 119.84 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 168.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.11 -50.89 36.14 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -142.67 158.15 43.95 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.78 0.832 . . . . 0.0 110.565 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -142.76 125.46 15.93 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.303 0.641 . . . . 0.0 109.824 -169.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -154.52 175.22 13.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.568 0.747 . . . . 0.0 109.546 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 11.5 p -118.31 142.94 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 171.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.455 ' HG3' ' HG3' ' A' ' 17' ' ' LYS . 0.3 OUTLIER -150.57 120.87 7.31 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.805 0.842 . . . . 0.0 108.983 -176.264 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.455 ' HG3' ' HG3' ' A' ' 16' ' ' ARG . 27.7 mtpp 60.98 29.45 19.02 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.396 1.078 . . . . 0.0 111.747 178.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.3 -13.44 65.12 Favored Glycine 0 C--N 1.353 1.51 0 CA-C-N 116.091 -0.504 . . . . 0.0 113.457 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -103.72 117.6 34.77 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.729 0.811 . . . . 0.0 110.092 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 53.0 t -69.33 110.14 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.62 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 69.5 mt-10 -98.7 144.51 27.89 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.203 1.001 . . . . 0.0 110.477 -176.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.6 ' HB3' HD12 ' A' ' 10' ' ' ILE . 74.5 m-85 -126.78 116.95 21.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.726 -1.124 . . . . 0.0 108.573 -174.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.58 102.2 0.88 Allowed 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 166.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -87.65 117.03 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -81.65 113.38 19.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 172.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -84.26 125.28 32.09 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -61.19 -43.1 99.42 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.482 0.713 . . . . 0.0 112.048 -169.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.78 4.55 83.54 Favored Glycine 0 C--N 1.344 0.982 0 CA-C-O 119.609 -0.551 . . . . 0.0 114.177 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.555 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 39.0 m95 -120.99 143.12 36.11 Favored Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 123.499 0.72 . . . . 0.0 110.177 -178.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.37 152.13 82.71 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.93 2.42 . . . . 0.0 111.914 176.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.75 -34.1 5.46 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 124.893 3.729 . . . . 0.0 117.108 -171.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -69.98 -17.37 63.29 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.812 0.733 . . . . 0.0 112.816 -173.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -88.54 4.97 44.89 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.854 0.462 . . . . 0.0 111.713 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -64.15 124.25 21.18 Favored 'General case' 0 C--N 1.351 0.655 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.0 p -112.13 127.3 55.89 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.291 0.636 . . . . 0.0 112.009 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -75.88 78.91 2.78 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.789 0.835 . . . . 0.0 109.919 175.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.472 ' HG3' ' HA ' ' B' ' 9' ' ' M3L . 13.8 mm-40 -104.47 143.69 27.2 Favored Pre-proline 0 N--CA 1.474 0.77 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.62 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 92.4 Cg_endo -77.97 176.72 9.66 Favored 'Trans proline' 0 C--N 1.375 1.973 0 C-N-CA 122.264 1.976 . . . . 0.0 113.474 -172.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -48.21 -22.45 0.66 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.887 1.675 . . . . 0.0 113.816 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -56.61 -31.01 63.88 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 125.69 1.596 . . . . 0.0 113.289 175.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.635 ' HD2' ' HB1' ' B' ' 7' ' ' ALA . 9.4 p-80 -87.13 -8.83 56.59 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.225 0.61 . . . . 0.0 112.359 -168.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 26.4 mm -80.18 122.69 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 123.124 0.569 . . . . 0.0 110.956 -171.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.578 HD11 ' HG3' ' B' ' 8' ' ' ARG . 6.8 mp -96.29 -15.97 21.63 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 177.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -150.94 130.46 6.6 Favored Pre-proline 0 N--CA 1.473 0.677 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -176.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.63 -25.35 54.56 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 123.162 2.575 . . . . 0.0 113.692 -173.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.12 -19.53 61.61 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.004 0.522 . . . . 0.0 111.546 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.478 HD13 HG21 ' A' ' 7' ' ' VAL . 10.7 tp -60.29 -47.21 87.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.881 0.472 . . . . 0.0 110.994 176.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.37 -46.65 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.512 0.725 . . . . 0.0 110.448 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -62.46 -54.26 42.71 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.762 -175.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -29.23 70.04 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 118.13 0.423 . . . . 0.0 111.692 -178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -57.17 -56.92 15.59 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.898 0.479 . . . . 0.0 109.955 172.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -72.85 -18.89 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.178 0.591 . . . . 0.0 111.044 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 63.49 24.57 14.13 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.327 1.451 . . . . 0.0 109.527 -165.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -70.26 108.26 4.1 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 125.682 1.593 . . . . 0.0 109.771 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -136.87 76.44 1.59 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 . . . . . 0 C--O 1.249 1.048 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 175.969 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -129.49 148.33 51.38 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.393 1.077 . . . . 0.0 109.542 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 37.8 m -103.71 115.83 31.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.682 0.793 . . . . 0.0 109.298 176.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -66.9 135.88 54.52 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 174.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 20.1 mp0 -65.2 -40.48 94.25 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.005 0.522 . . . . 0.0 110.632 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 10.9 m 70.05 138.59 0.04 OUTLIER 'General case' 0 C--O 1.253 1.287 0 C-N-CA 124.604 1.162 . . . . 0.0 112.231 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.635 ' HB1' ' HD2' ' A' ' 41' ' ' HIS . . . -146.37 135.39 22.57 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.334 -175.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.578 ' HG3' HD11 ' A' ' 43' ' ' LEU . 44.7 mtp180 -74.41 163.51 27.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 166.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.472 ' HA ' ' HG3' ' A' ' 37' ' ' GLU . . . . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 168.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 76.3 p -158.88 159.77 35.39 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.19 178.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 55.2 m -78.73 100.6 7.15 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.64 93.62 0.18 Allowed Glycine 0 C--N 1.343 0.941 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.675 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -155.63 -70.18 0.01 OUTLIER Glycine 0 C--N 1.339 0.746 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -111.05 139.07 46.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.928 0.891 . . . . 0.0 109.458 176.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.829 0 C-N-CA 123.822 0.849 . . . . 0.0 109.917 -178.519 . . . . . . . . 0 0 . 1 stop_ save_