data_2kzv_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 2kzv _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 ' 7' ' ' HIS . . . . . 0.54 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 37.9 Cg_exo -60.69 126.68 20.41 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.05 1.834 . . . . 0.0 111.826 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mp -65.32 -42.26 93.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.197 -0.94 . . . . 0.0 109.366 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -55.18 -53.05 60.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.285 -0.884 . . . . 0.0 110.151 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -67.06 -39.44 86.88 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.117 -0.989 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 49.1 ttp -61.09 -50.09 74.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.249 -0.907 . . . . 0.0 110.045 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -67.47 -38.32 84.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.974 -1.079 . . . . 0.0 109.316 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -46.52 89.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.052 -1.03 . . . . 0.0 109.788 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.4 m -62.38 -43.13 99.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 110.399 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.76 -43.1 84.97 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.022 -1.049 . . . . 0.0 110.613 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.95 -44.83 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 109.609 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -67.26 -34.07 76.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.36 -0.837 . . . . 0.0 109.763 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.57 94.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.354 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.88 7.19 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.317 -0.864 . . . . 0.0 110.183 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -7.11 15.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.928 -1.107 . . . . 0.0 109.695 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.645 ' HG2' HH11 ' A' ' 22' ' ' ARG . 12.1 mtp85 -71.2 -19.93 62.33 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.31 -0.869 . . . . 0.0 108.883 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -61.34 -50.96 70.83 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.206 -0.934 . . . . 0.0 109.481 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 26' ' ' TRP . 2.5 m -179.78 77.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.544 -0.722 . . . . 0.0 109.263 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.0 -91.14 0.02 OUTLIER Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' A' ' 24' ' ' SER . 70.2 m95 -54.7 -174.07 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.444 -1.033 . . . . 0.0 109.985 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.04 134.29 29.57 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.661 -0.649 . . . . 0.0 109.343 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.36 134.63 48.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.342 -0.849 . . . . 0.0 109.335 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.56 -40.58 75.41 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 109.405 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 t -59.34 -43.14 92.8 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.108 -0.995 . . . . 0.0 109.161 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.22 88.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.252 -0.905 . . . . 0.0 109.617 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.45 -46.95 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.242 -0.911 . . . . 0.0 109.363 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.15 81.74 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.9 m -62.45 -42.57 99.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.162 -1.199 . . . . 0.0 109.688 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.546 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 67.8 t80 -60.75 -48.6 81.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.857 . . . . 0.0 109.387 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.5 mt -64.16 -39.08 93.26 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 108.984 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.37 -48.56 80.21 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.99 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -73.15 -51.2 18.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.106 -0.996 . . . . 0.0 110.411 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.546 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 68.8 m-80 -65.43 -39.97 92.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.265 -0.897 . . . . 0.0 109.808 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 31.7 m-20 -123.86 84.66 54.21 Favored Pre-proline 0 N--CA 1.502 2.138 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.32 -28.46 62.76 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.997 1.798 . . . . 0.0 111.333 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.1 p -67.54 -11.83 58.93 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.492 -0.755 . . . . 0.0 109.618 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -75.73 122.63 24.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.12 -0.987 . . . . 0.0 109.122 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -119.58 90.12 42.31 Favored Pre-proline 0 N--CA 1.505 2.278 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -63.28 -20.35 70.34 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.811 1.674 . . . . 0.0 110.776 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -62.71 -38.89 92.25 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.31 -37.97 85.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.296 -0.878 . . . . 0.0 108.725 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.526 ' CD2' ' SD ' ' A' ' 56' ' ' MET . 97.4 m95 -83.95 9.78 11.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.241 -0.912 . . . . 0.0 109.336 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 69.17 151.46 0.45 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.44 ' C ' ' H ' ' A' ' 52' ' ' ARG . 86.7 t60 -79.15 147.69 32.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.354 -1.086 . . . . 0.0 109.549 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.13 -40.01 0.7 Allowed Glycine 0 N--CA 1.494 2.513 0 N-CA-C 110.222 -1.151 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.44 ' H ' ' C ' ' A' ' 50' ' ' HIS . 89.4 mtt180 -67.44 -4.89 12.52 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.125 -1.221 . . . . 0.0 108.933 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.66 -40.8 98.2 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -60.53 -42.81 97.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.333 -0.855 . . . . 0.0 109.282 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.406 ' CD ' ' N ' ' A' ' 55' ' ' GLN . 21.8 mp0 -69.15 -27.12 65.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.86 . . . . 0.0 109.565 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.526 ' SD ' ' CD2' ' A' ' 48' ' ' TRP . 46.6 ttp -63.93 -48.73 75.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.932 -1.105 . . . . 0.0 109.481 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.8 m -69.16 -23.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.276 -0.89 . . . . 0.0 109.612 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.8 -28.62 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.485 -0.759 . . . . 0.0 109.378 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -77.49 -4.13 43.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.96 . . . . 0.0 109.567 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.92 109.82 22.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.352 -0.843 . . . . 0.0 108.984 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.498 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.4 m-20 -64.52 -39.37 93.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.495 -0.753 . . . . 0.0 111.192 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -70.29 19.29 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.851 -1.156 . . . . 0.0 111.288 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.7 mt -138.15 126.61 23.33 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.26 -0.9 . . . . 0.0 108.857 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 43.2 m -88.59 130.97 35.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.6 t -115.6 130.67 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 121.574 -0.704 . . . . 0.0 109.356 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.413 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -142.3 153.72 44.12 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.462 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.3 mp0 -107.46 119.11 38.51 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.4 m -85.49 155.86 21.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.216 -0.927 . . . . 0.0 108.511 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.83 83.17 4.75 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.543 ' ND2' ' CE1' ' A' ' 75' ' ' HIS . 52.6 t-20 -94.0 104.92 16.95 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.417 -0.802 . . . . 0.0 109.502 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.17 -142.09 44.92 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.62 -6.39 58.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.405 -1.056 . . . . 0.0 109.745 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -106.07 142.08 36.37 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.528 -0.732 . . . . 0.0 109.685 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.2 mt -91.6 123.39 34.97 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.543 ' CE1' ' ND2' ' A' ' 70' ' ' ASN . 48.2 m170 -101.9 135.63 43.12 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.605 -0.684 . . . . 0.0 109.299 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.1 m -79.24 148.48 32.19 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.412 -0.805 . . . . 0.0 109.133 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.6 mp0 -137.34 155.02 49.9 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.6 pt -134.48 153.6 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.734 -0.603 . . . . 0.0 109.386 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -143.58 148.77 36.4 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.76 120.46 27.21 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.442 -0.786 . . . . 0.0 110.314 -179.051 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -45.83 138.8 11.48 Favored 'Trans proline' 0 N--CA 1.495 1.568 0 C-N-CA 121.701 1.601 . . . . 0.0 112.066 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.95 -41.48 97.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.409 -0.807 . . . . 0.0 109.436 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -57.77 -46.02 85.14 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.387 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.1 -39.1 93.32 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.214 -0.929 . . . . 0.0 109.344 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.73 -52.58 62.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 110.011 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.96 -41.6 74.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.936 -1.102 . . . . 0.0 109.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -60.5 -44.91 95.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.477 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 m -62.33 -42.22 99.2 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.71 79.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -63.05 -44.81 99.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.129 -0.982 . . . . 0.0 109.404 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.14 -32.04 72.88 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.391 -0.818 . . . . 0.0 109.721 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.89 94.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.0 110.72 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 m -124.12 28.76 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.687 0 O-C-N 121.43 -0.794 . . . . 0.0 110.55 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.91 -34.13 62.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.844 -1.16 . . . . 0.0 110.086 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 23' ' ' ASP . 35.8 mtm-85 44.95 77.14 0.08 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.241 -0.912 . . . . 0.0 109.741 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 22' ' ' ARG . 83.9 m-20 57.69 150.39 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.946 0.879 . . . . 0.0 111.014 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.8 m 57.98 157.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.503 -0.748 . . . . 0.0 110.229 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.73 0.22 86.6 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.12 144.69 27.38 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.313 -1.11 . . . . 0.0 109.587 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.75 139.12 29.27 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.457 -0.777 . . . . 0.0 108.93 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.07 131.22 45.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.165 -0.959 . . . . 0.0 109.745 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.13 -37.5 74.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.509 -0.744 . . . . 0.0 109.589 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -57.19 -44.01 83.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.149 -0.969 . . . . 0.0 109.203 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.9 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.211 -0.931 . . . . 0.0 109.271 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.69 -48.32 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.285 -0.884 . . . . 0.0 109.355 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.38 86.56 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 m -62.94 -42.29 99.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.163 -1.198 . . . . 0.0 109.529 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.551 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 76.8 t80 -60.7 -47.09 87.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.352 -0.843 . . . . 0.0 109.476 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.4 mt -62.51 -42.09 99.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.086 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.66 -42.61 79.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.061 -1.025 . . . . 0.0 109.495 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.31 -42.19 96.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.15 -0.969 . . . . 0.0 109.561 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.551 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 81.0 m-20 -90.09 5.14 48.04 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.193 -0.942 . . . . 0.0 109.287 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 36' ' ' LEU . 49.2 t0 -162.7 73.13 2.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.34 -15.82 49.4 Favored 'Trans proline' 0 N--CA 1.489 1.262 0 C-N-CA 121.226 1.284 . . . . 0.0 111.006 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.1 m -74.49 -7.87 54.45 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -74.75 136.36 41.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.475 -0.765 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.12 92.67 45.78 Favored Pre-proline 0 N--CA 1.506 2.33 0 O-C-N 121.949 -0.469 . . . . 0.0 110.151 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -64.01 -16.31 54.16 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 122.061 1.841 . . . . 0.0 111.882 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.453 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 5.3 mpt_? -64.49 -39.88 94.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -63.48 -37.49 87.5 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -92.85 22.62 4.71 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.282 -0.886 . . . . 0.0 108.742 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.31 160.53 3.15 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -77.99 -18.5 55.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.345 -1.091 . . . . 0.0 109.57 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -135.83 -19.25 0.73 Allowed Glycine 0 N--CA 1.505 3.244 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -67.88 2.89 1.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.11 -1.229 . . . . 0.0 109.122 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 51' ' ' GLY . 64.4 tp -62.43 -38.35 89.39 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.665 ' HG ' ' HG ' ' A' ' 76' ' ' SER . 38.8 t -58.95 -42.56 90.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.17 -0.956 . . . . 0.0 109.145 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -66.17 -30.37 70.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.534 -0.729 . . . . 0.0 109.775 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.7 75.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.856 -1.152 . . . . 0.0 110.046 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.12 -17.96 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.246 -0.909 . . . . 0.0 109.801 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.67 -29.21 69.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.359 -0.838 . . . . 0.0 109.369 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.03 -32.22 73.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 63.3 mt -71.93 112.8 8.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 109.228 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.3 m-20 -64.4 -40.89 96.68 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.5 -0.75 . . . . 0.0 111.387 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -69.78 20.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.727 -1.233 . . . . 0.0 111.347 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.8 mt -137.82 133.48 34.02 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.222 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.474 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 89.2 m -97.58 135.28 39.63 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -118.11 132.92 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -134.87 117.86 16.33 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -97.65 119.35 36.06 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.548 -0.72 . . . . 0.0 109.191 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.6 m -102.67 122.29 44.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.571 -0.706 . . . . 0.0 109.357 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 133.49 43.77 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.987 -1.07 . . . . 0.0 109.227 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.1 t-20 -149.89 95.68 2.34 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.561 -0.712 . . . . 0.0 109.482 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 62.99 -139.47 44.78 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 t -83.85 -7.33 59.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.403 -1.057 . . . . 0.0 110.387 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -125.59 123.4 38.96 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.504 -0.748 . . . . 0.0 109.293 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -87.06 153.97 21.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.103 -0.998 . . . . 0.0 108.775 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -105.23 99.79 9.4 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.546 -0.721 . . . . 0.0 109.102 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.665 ' HG ' ' HG ' ' A' ' 54' ' ' SER . 16.1 t -74.56 145.85 43.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.608 -0.683 . . . . 0.0 109.343 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -139.91 155.69 47.05 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.1 pt -133.33 151.05 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 CA-C-O 121.252 0.549 . . . . 0.0 109.592 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -151.94 141.48 21.69 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 19.8 mt -74.38 139.01 43.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.283 -0.885 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.474 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 22.4 mmt180 . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.234 -0.916 . . . . 0.0 109.465 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.41 143.22 97.95 Favored 'Trans proline' 0 N--CA 1.502 2.022 0 C-N-CA 121.965 1.776 . . . . 0.0 111.921 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.406 ' N ' ' CD1' ' A' ' 9' ' ' LEU . 10.0 mp -63.35 -43.94 96.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.144 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -63.76 -47.63 80.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.812 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -63.77 -35.76 81.65 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.363 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 ttt -64.15 -61.0 2.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.396 -0.815 . . . . 0.0 110.032 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -65.21 -39.95 93.47 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.15 -0.969 . . . . 0.0 109.974 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -61.12 -45.3 95.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.001 -1.062 . . . . 0.0 109.882 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.508 ' HG ' ' N ' ' A' ' 16' ' ' ALA . 78.2 p -61.56 -43.56 98.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.023 -1.048 . . . . 0.0 109.981 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.508 ' N ' ' HG ' ' A' ' 15' ' ' SER . . . -73.55 -48.15 35.24 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 110.706 -179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.443 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.0 mt -63.11 -44.63 99.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 0.0 109.542 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -66.5 -35.16 79.57 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.304 -0.872 . . . . 0.0 109.936 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -38.65 91.97 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.0 110.02 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 m -110.41 11.54 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 121.608 -0.683 . . . . 0.0 109.789 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -59.82 -23.49 63.39 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.879 -1.138 . . . . 0.0 108.713 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' A' ' 24' ' ' SER . 37.3 mtt180 51.77 29.04 5.41 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.6 -0.688 . . . . 0.0 109.85 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 55.4 8.42 0.29 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.374 -0.829 . . . . 0.0 110.5 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.404 ' H ' ' C ' ' A' ' 22' ' ' ARG . 94.6 p -87.7 -3.52 58.96 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.812 -1.18 . . . . 0.0 108.804 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.66 -59.03 5.0 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.461 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 99.1 m95 -75.4 177.22 6.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.407 -1.055 . . . . 0.0 109.442 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 137.3 9.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.264 -0.898 . . . . 0.0 108.874 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -69.39 125.71 27.54 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.286 -0.884 . . . . 0.0 109.424 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.4 tp -57.73 -40.0 78.59 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.675 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -57.42 -42.27 82.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.064 -1.022 . . . . 0.0 109.132 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.17 89.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.221 -0.924 . . . . 0.0 109.528 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.63 -48.39 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 109.493 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.04 -42.7 99.88 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.1 p -66.25 -40.79 90.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -1.19 . . . . 0.0 109.967 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -61.61 -44.69 96.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.1 mt -61.41 -41.83 97.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.123 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.49 -39.55 84.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.346 -0.846 . . . . 0.0 109.094 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -61.6 -46.09 91.34 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.277 -0.889 . . . . 0.0 109.481 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -88.57 -4.51 58.57 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.145 -0.972 . . . . 0.0 109.167 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 36' ' ' LEU . 4.4 m-20 -153.56 64.28 4.87 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.0 -18.5 63.93 Favored 'Trans proline' 0 N--CA 1.494 1.506 0 C-N-CA 121.5 1.467 . . . . 0.0 111.034 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.0 m -76.14 -7.01 53.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 108.578 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -75.95 164.62 25.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.533 -0.73 . . . . 0.0 109.3 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -131.13 79.61 70.55 Favored Pre-proline 0 N--CA 1.504 2.261 0 O-C-N 121.611 -0.681 . . . . 0.0 110.116 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.17 -36.33 92.94 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.95 1.767 . . . . 0.0 111.142 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.58 -34.32 77.55 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.298 0.57 . . . . 0.0 110.158 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.467 ' C ' ' H ' ' A' ' 49' ' ' GLY . 44.6 t30 -60.0 -36.59 77.54 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 108.99 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -78.36 24.56 0.26 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.243 -0.911 . . . . 0.0 109.265 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 74.51 161.8 8.48 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.533 ' C ' ' H ' ' A' ' 52' ' ' ARG . 99.5 m-70 -90.7 123.84 34.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.273 -1.134 . . . . 0.0 109.558 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 69.59 -21.63 0.43 Allowed Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.533 ' H ' ' C ' ' A' ' 50' ' ' HIS . 76.2 mtp85 -71.39 -1.88 14.57 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.185 -1.185 . . . . 0.0 109.007 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.9 tp -61.77 -37.71 85.33 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -58.89 -41.97 88.44 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.361 -0.837 . . . . 0.0 109.319 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -65.65 -31.65 72.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.191 -0.943 . . . . 0.0 109.862 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.7 tpt -64.78 -48.6 73.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.87 -1.144 . . . . 0.0 109.962 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.0 m -75.14 -16.27 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.116 -0.99 . . . . 0.0 109.678 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -60.92 -28.13 68.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.424 -0.797 . . . . 0.0 109.688 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -70.37 -3.3 16.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.133 -0.979 . . . . 0.0 109.006 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.0 mt -99.92 124.59 45.41 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.499 -0.75 . . . . 0.0 109.058 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.7 p-10 -73.44 -36.63 65.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.441 -0.787 . . . . 0.0 111.622 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.461 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 51.6 p90 -73.5 18.81 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.684 -1.26 . . . . 0.0 110.907 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.6 mt -136.33 125.03 23.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.318 -0.864 . . . . 0.0 109.165 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.8 m -89.31 141.95 28.09 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.367 -0.833 . . . . 0.0 109.09 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.5 t -116.06 130.35 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.618 0.723 . . . . 0.0 109.396 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.461 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 51.1 tt0 -153.78 150.63 28.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -140.48 127.91 21.32 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.384 -0.823 . . . . 0.0 109.079 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.7 p -81.71 154.45 26.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.889 -1.132 . . . . 0.0 108.724 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.576 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -90.34 132.45 35.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.215 -0.928 . . . . 0.0 108.711 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -150.66 98.82 2.67 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.886 -1.134 . . . . 0.0 109.643 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 55.51 -140.89 39.54 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 62.1 m -86.32 -7.84 58.17 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.26 -1.141 . . . . 0.0 109.655 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -103.14 118.21 36.28 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.339 -0.851 . . . . 0.0 109.491 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.11 134.82 33.47 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -100.87 104.31 15.53 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 m -74.2 148.84 41.26 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.435 -0.791 . . . . 0.0 109.174 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -141.5 152.04 43.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.426 -0.796 . . . . 0.0 108.945 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.3 pt -139.97 152.12 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.659 -0.65 . . . . 0.0 109.437 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -157.04 154.76 30.05 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.93 138.18 58.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.116 -0.99 . . . . 0.0 109.757 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.8 ttp85 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 109.799 -179.487 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.574 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 44.6 Cg_exo -58.41 127.9 26.44 Favored 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 121.095 1.197 . . . . 0.0 112.055 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.53 -40.27 80.81 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.464 -0.773 . . . . 0.0 109.091 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -56.82 -45.63 82.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -0.94 . . . . 0.0 109.307 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -65.0 -36.97 86.13 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.355 -0.841 . . . . 0.0 109.217 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.4 ttp -62.66 -53.74 49.93 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.418 -0.801 . . . . 0.0 110.0 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -70.7 -41.5 71.89 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.917 -1.115 . . . . 0.0 110.123 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.2 m -60.58 -45.89 92.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.883 -1.135 . . . . 0.0 110.119 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -61.41 -45.15 95.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.47 77.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.204 -0.935 . . . . 0.0 111.106 -178.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.1 mt -61.87 -46.96 95.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.114 -0.991 . . . . 0.0 109.451 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.88 -29.23 69.07 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.433 -0.792 . . . . 0.0 109.8 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.22 -42.89 96.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.149 -0.97 . . . . 0.0 110.708 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.472 ' C ' ' H ' ' A' ' 22' ' ' ARG . 12.6 m -111.98 20.45 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.512 -0.742 . . . . 0.0 109.989 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 2.82 1.31 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.825 -1.172 . . . . 0.0 109.321 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.0 mmt180 61.19 -146.34 0.44 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -59.9 -49.99 75.54 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.626 -0.671 . . . . 0.0 110.178 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t 176.76 87.72 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.284 -0.885 . . . . 0.0 108.804 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.59 -171.2 38.59 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.468 -1.348 . . . . 0.0 109.888 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -58.77 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.67 -0.9 . . . . 0.0 109.556 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.69 142.36 30.01 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.462 -0.774 . . . . 0.0 109.166 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.93 132.85 48.09 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.161 -0.962 . . . . 0.0 110.085 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.27 -39.79 80.14 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.206 -0.934 . . . . 0.0 109.275 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.53 ' HG ' ' N ' ' A' ' 31' ' ' ALA . 80.5 p -55.8 -42.4 75.54 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 109.241 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.53 ' N ' ' HG ' ' A' ' 30' ' ' SER . . . -63.62 -37.39 87.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.582 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.29 -48.29 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.096 -1.003 . . . . 0.0 109.901 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.61 -46.74 93.49 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -64.76 -42.89 94.78 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.109 -1.23 . . . . 0.0 110.094 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.536 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 68.3 t80 -61.21 -48.4 81.67 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.232 -0.917 . . . . 0.0 109.736 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 40' ' ' ASP . 90.1 mt -63.12 -41.97 99.44 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.396 -0.815 . . . . 0.0 109.11 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.33 93.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 108.936 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -64.14 -44.77 91.15 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.295 -0.878 . . . . 0.0 109.707 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.536 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.8 m-80 -82.99 -8.24 59.58 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.188 -0.945 . . . . 0.0 109.494 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.48 ' N ' ' O ' ' A' ' 36' ' ' LEU . 5.1 m-20 -153.76 77.22 5.83 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.37 -30.29 62.46 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.804 1.669 . . . . 0.0 111.115 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 83.6 p -69.01 -12.47 61.72 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.617 -0.677 . . . . 0.0 109.678 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -76.84 122.85 25.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.975 . . . . 0.0 108.399 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -115.41 96.77 46.82 Favored Pre-proline 0 N--CA 1.506 2.368 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.7 -7.42 20.12 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 CA-C-N 120.187 1.103 . . . . 0.0 111.254 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -62.79 -41.45 99.28 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -62.76 -37.48 86.77 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.439 -0.788 . . . . 0.0 109.151 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -81.51 26.4 0.47 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.274 -0.891 . . . . 0.0 109.359 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 56.75 98.91 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -48.93 -28.66 3.99 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -1.187 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.518 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -96.18 -55.54 1.27 Allowed Glycine 0 N--CA 1.502 3.072 0 N-CA-C 108.771 -1.731 . . . . 0.0 108.771 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -62.94 2.75 0.28 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.39 -1.065 . . . . 0.0 109.607 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.518 ' H ' ' C ' ' A' ' 51' ' ' GLY . 57.4 tp -60.44 -42.23 95.69 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.2 t -62.91 -25.93 68.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.489 -0.757 . . . . 0.0 109.739 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -85.09 -34.97 22.1 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 120.976 -1.077 . . . . 0.0 110.056 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.69 -43.58 88.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.887 -1.133 . . . . 0.0 109.872 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 m -63.33 -20.65 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.082 -1.011 . . . . 0.0 109.647 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -69.45 -19.78 63.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.357 -0.839 . . . . 0.0 109.537 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -86.6 0.4 54.51 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.204 -0.935 . . . . 0.0 109.616 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' PHE . 90.5 mt -85.44 -5.48 59.29 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.922 -1.111 . . . . 0.0 109.015 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.563 ' C ' ' H ' ' A' ' 63' ' ' LEU . 8.6 m-20 57.85 -65.29 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.526 -0.734 . . . . 0.0 111.958 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 60' ' ' LEU . 52.6 p90 -63.21 19.07 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.63 -1.294 . . . . 0.0 111.999 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' ' 61' ' ' ASP . 8.1 mt -136.21 128.91 30.8 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.061 -1.024 . . . . 0.0 108.875 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 60.8 m -89.26 140.74 29.18 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.8 t -119.18 131.52 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 O-C-N 121.482 -0.761 . . . . 0.0 109.239 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -141.56 151.85 43.56 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.92 120.03 41.13 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -91.57 151.03 20.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.243 -0.911 . . . . 0.0 108.57 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -91.85 114.27 26.76 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -149.99 118.01 6.32 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.267 -0.896 . . . . 0.0 110.161 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 73' ' ' LYS . . . 56.68 -171.11 2.55 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.2 m -78.41 28.94 0.19 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.412 -1.052 . . . . 0.0 109.61 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.437 ' H ' ' C ' ' A' ' 71' ' ' GLY . 88.7 tttt -144.78 119.56 9.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.301 -0.874 . . . . 0.0 109.076 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 mt -68.12 132.68 47.64 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 m170 -101.31 119.13 38.29 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.557 -0.714 . . . . 0.0 109.229 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.3 t -71.41 149.74 45.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 109.397 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -141.2 148.76 40.47 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -133.64 147.32 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.558 -0.714 . . . . 0.0 109.563 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -157.98 154.02 27.08 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.29 136.85 57.08 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.607 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.6 m80 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -47.84 135.04 23.02 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.353 1.369 . . . . 0.0 111.969 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.9 -42.69 97.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.171 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -59.97 -47.82 84.22 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.251 -0.906 . . . . 0.0 109.437 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.3 -35.44 80.38 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.724 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.58 -50.83 69.73 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.279 -0.888 . . . . 0.0 110.35 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -69.16 -48.68 61.61 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.859 -1.151 . . . . 0.0 110.312 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.4 p -60.65 -43.84 97.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.975 -1.078 . . . . 0.0 110.257 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m -60.64 -44.32 96.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.11 -0.994 . . . . 0.0 110.176 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.54 -41.96 75.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 110.505 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 21' ' ' ALA . 93.6 mt -63.64 -46.18 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.161 -0.962 . . . . 0.0 109.93 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.66 -33.96 77.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.025 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.64 91.71 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.166 -0.959 . . . . 0.0 109.913 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.1 m -101.74 -2.78 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 O-C-N 121.364 -0.835 . . . . 0.0 109.968 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.529 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -62.12 -23.45 66.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.966 -1.084 . . . . 0.0 108.896 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 61.74 -2.97 0.24 Allowed 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.402 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.529 ' H ' ' C ' ' A' ' 21' ' ' ALA . 8.8 p30 -175.11 -101.41 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.799 -1.188 . . . . 0.0 108.827 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.486 ' H ' ' CG ' ' A' ' 23' ' ' ASP . 29.9 t -162.02 91.96 0.82 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.925 -1.109 . . . . 0.0 108.89 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.09 -149.35 8.23 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.418 ' CH2' ' CD ' ' A' ' 66' ' ' GLN . 99.2 m95 -68.04 -178.44 1.01 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.632 -0.922 . . . . 0.0 110.044 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -159.57 149.92 19.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.372 -0.83 . . . . 0.0 108.912 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 40.6 mp0 -76.98 128.42 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.244 -0.91 . . . . 0.0 109.581 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.85 -39.85 78.69 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.535 ' HG ' ' N ' ' A' ' 31' ' ' ALA . 78.4 p -55.63 -43.0 75.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.067 -1.021 . . . . 0.0 109.612 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.535 ' N ' ' HG ' ' A' ' 30' ' ' SER . . . -64.55 -38.22 90.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.131 -0.98 . . . . 0.0 109.546 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.3 t -62.7 -48.22 89.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.163 -0.961 . . . . 0.0 109.544 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.85 -48.65 85.19 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -63.2 -42.63 99.35 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.179 -1.189 . . . . 0.0 109.505 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.557 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 83.7 t80 -60.12 -45.51 92.75 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.851 . . . . 0.0 109.505 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 40' ' ' ASP . 66.5 mt -61.67 -43.06 99.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.963 . . . . 0.0 109.187 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.46 91.0 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.16 -0.962 . . . . 0.0 109.132 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.9 -44.69 95.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.885 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.557 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.2 m-80 -89.61 2.04 55.21 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.247 -0.908 . . . . 0.0 109.226 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 36' ' ' LEU . 50.0 t0 -162.81 73.8 2.06 Favored Pre-proline 0 N--CA 1.493 1.696 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.03 -14.96 45.51 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.405 1.403 . . . . 0.0 111.306 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 88.2 p -74.95 -8.96 58.01 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -72.94 141.09 47.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.428 -0.795 . . . . 0.0 109.385 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -119.72 92.56 46.53 Favored Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.67 -0.644 . . . . 0.0 109.919 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.09 -19.29 40.38 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.009 1.806 . . . . 0.0 111.525 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -63.72 -36.53 84.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.505 -0.747 . . . . 0.0 109.199 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.02 -36.24 82.91 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.114 -0.991 . . . . 0.0 108.471 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -78.57 7.21 7.11 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.829 . . . . 0.0 109.394 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.92 152.23 0.04 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.499 ' C ' ' H ' ' A' ' 52' ' ' ARG . 59.3 t-80 -78.41 132.15 37.22 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -1.029 . . . . 0.0 109.603 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.57 -32.61 0.85 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.499 ' H ' ' C ' ' A' ' 50' ' ' HIS . 64.5 ttt180 -67.12 -12.01 58.8 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.272 -1.134 . . . . 0.0 108.49 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -61.34 -42.96 99.54 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 108.587 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -62.47 -42.82 99.75 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -69.14 -32.23 71.44 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.953 . . . . 0.0 109.918 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -46.31 88.99 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.095 -1.003 . . . . 0.0 109.783 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.1 -24.74 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.171 -0.955 . . . . 0.0 109.246 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.95 -29.27 69.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.504 -0.747 . . . . 0.0 109.725 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -70.87 -3.04 17.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.951 . . . . 0.0 109.783 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 64.2 mt -102.38 125.01 48.96 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 35.4 p-10 -68.19 -38.7 82.3 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.341 -0.85 . . . . 0.0 111.536 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.414 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 45.2 p90 -76.45 16.0 0.54 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.715 -1.24 . . . . 0.0 110.433 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.53 117.04 16.66 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.324 -0.86 . . . . 0.0 109.053 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.639 ' HG1' HH21 ' A' ' 81' ' ' ARG . 62.7 m -90.4 141.81 28.36 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.213 -0.929 . . . . 0.0 109.711 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.5 t -126.7 133.79 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CD ' ' CH2' ' A' ' 26' ' ' TRP . 86.6 mt-30 -141.05 137.04 32.62 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -102.37 121.18 41.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.52 -0.737 . . . . 0.0 109.122 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.8 m -92.45 141.74 28.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.279 -0.888 . . . . 0.0 108.998 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.567 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -88.11 90.42 8.38 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.269 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.711 HD21 ' HD1' ' A' ' 75' ' ' HIS . 98.3 m-20 -99.61 106.3 18.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.023 . . . . 0.0 109.676 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.33 -138.76 47.48 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.94 -8.4 57.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.273 -1.133 . . . . 0.0 109.802 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.605 ' HZ3' ' CD2' ' A' ' 75' ' ' HIS . 66.3 tttm -113.0 122.77 48.61 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.441 -0.787 . . . . 0.0 109.805 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mp -85.01 131.51 34.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.711 ' HD1' HD21 ' A' ' 70' ' ' ASN . 37.7 m80 -107.7 125.61 51.59 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-O 121.521 0.677 . . . . 0.0 109.41 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 t -70.8 154.64 41.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.547 -0.72 . . . . 0.0 109.635 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -137.84 154.86 49.46 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.9 pt -136.99 151.42 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 CA-C-O 121.444 0.64 . . . . 0.0 109.673 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.1 ttp85 -151.19 144.9 25.04 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.49 113.41 25.37 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.301 -0.874 . . . . 0.0 109.236 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.639 HH21 ' HG1' ' A' ' 64' ' ' THR . 61.6 ttm-85 . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.938 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 . . . . . 0 N--CA 1.499 1.997 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -45.03 138.02 9.26 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 121.573 1.516 . . . . 0.0 112.386 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 mt -63.58 -40.94 98.25 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.491 -0.755 . . . . 0.0 109.167 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.54 -38.39 77.69 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.472 -0.768 . . . . 0.0 108.947 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -61.73 -42.08 98.49 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.315 -0.865 . . . . 0.0 109.351 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 47.9 mmm -63.54 -44.85 93.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.137 -0.977 . . . . 0.0 109.326 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -69.5 -44.31 71.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.182 -0.949 . . . . 0.0 110.094 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.7 m -62.75 -46.23 89.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.058 -1.026 . . . . 0.0 110.206 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -67.71 -39.1 84.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.283 -0.886 . . . . 0.0 110.202 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -75.47 -48.89 20.64 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.048 -1.032 . . . . 0.0 110.897 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.15 -45.0 99.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.047 -1.033 . . . . 0.0 109.347 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.86 -31.76 72.58 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.383 -0.823 . . . . 0.0 109.71 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.52 96.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.986 -1.071 . . . . 0.0 110.303 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.1 m -118.97 23.94 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.477 -0.764 . . . . 0.0 109.613 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.04 -33.49 70.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.905 -1.122 . . . . 0.0 109.372 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 24' ' ' SER . 20.5 mtm180 51.8 97.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.819 . . . . 0.0 110.476 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 51.07 -82.7 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 110.668 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' ARG . 11.6 p -65.14 157.86 27.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.184 -0.948 . . . . 0.0 109.642 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.1 1.85 78.34 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.411 ' CH2' ' OE1' ' A' ' 66' ' ' GLN . 96.5 m95 -85.03 148.8 25.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.074 -1.25 . . . . 0.0 109.26 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.41 145.68 31.23 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.359 -0.838 . . . . 0.0 109.027 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.14 132.35 46.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.897 . . . . 0.0 109.497 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.2 tp -56.73 -39.94 74.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.46 -0.775 . . . . 0.0 109.275 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.6 m -58.57 -44.04 89.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.141 -0.974 . . . . 0.0 109.267 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.38 -36.48 80.37 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 109.593 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.42 -48.24 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.232 -0.917 . . . . 0.0 109.312 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.82 -48.78 78.3 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.2 t -62.17 -45.11 94.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.125 -1.22 . . . . 0.0 109.745 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.466 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 74.7 t80 -60.09 -48.53 81.34 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.295 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.93 -39.56 90.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 109.382 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.53 75.98 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.057 -1.027 . . . . 0.0 109.824 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -62.44 -41.08 98.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.075 -1.016 . . . . 0.0 109.526 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.466 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 5.0 m120 -64.36 -40.28 95.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.221 -0.924 . . . . 0.0 109.353 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.28 152.58 58.36 Favored Pre-proline 0 N--CA 1.497 1.922 0 O-C-N 121.19 -0.944 . . . . 0.0 108.683 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -45.97 -43.91 19.4 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.439 1.426 . . . . 0.0 111.312 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.9 m -145.65 -92.82 0.09 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.6 t80 61.81 144.71 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.912 0.863 . . . . 0.0 108.99 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -158.76 94.35 1.87 Allowed Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 121.536 -0.727 . . . . 0.0 109.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -70.35 -22.77 28.9 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 CA-C-N 119.536 0.87 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -66.05 -51.68 56.0 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.321 -0.862 . . . . 0.0 109.423 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -64.0 -11.23 27.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.238 -0.914 . . . . 0.0 110.341 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.429 ' HE3' ' HE ' ' A' ' 52' ' ' ARG . 2.4 m95 -81.16 3.01 25.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.904 -1.123 . . . . 0.0 108.954 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.47 164.2 12.6 Favored Glycine 0 N--CA 1.51 3.623 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -73.24 129.36 37.88 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.314 -1.109 . . . . 0.0 109.83 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . 83.82 -89.87 1.57 Allowed Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.429 ' HE ' ' HE3' ' A' ' 48' ' ' TRP . 1.2 tmt_? 50.14 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.994 -0.709 . . . . 0.0 110.613 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.561 ' N ' ' O ' ' A' ' 51' ' ' GLY . 41.6 tp -49.37 -35.99 20.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.0 t -66.58 -36.53 82.86 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.295 0.569 . . . . 0.0 109.649 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -86.2 -32.44 21.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.995 -1.066 . . . . 0.0 110.244 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.8 mtp -64.38 -38.95 92.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.009 -1.057 . . . . 0.0 108.825 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.2 -26.78 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 120.757 -1.214 . . . . 0.0 110.069 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.35 -40.43 82.17 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.187 -0.946 . . . . 0.0 110.635 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -75.43 -0.47 20.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.923 -1.11 . . . . 0.0 110.263 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.1 mt -102.65 115.42 30.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.234 -0.917 . . . . 0.0 109.267 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.441 ' C ' ' H ' ' A' ' 63' ' ' LEU . 68.0 t0 -65.87 -42.5 90.3 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.355 -0.841 . . . . 0.0 111.473 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -71.87 15.32 0.15 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.868 -1.145 . . . . 0.0 110.806 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.441 ' H ' ' C ' ' A' ' 61' ' ' ASP . 0.6 OUTLIER -129.23 117.87 21.43 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.391 -0.818 . . . . 0.0 108.954 -179.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 51.0 m -88.2 144.74 26.27 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.302 -0.874 . . . . 0.0 109.29 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 49.1 t -118.69 130.79 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 CA-C-O 121.531 0.681 . . . . 0.0 109.851 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.411 ' OE1' ' CH2' ' A' ' 26' ' ' TRP . 49.8 tt0 -145.13 152.64 40.37 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.492 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 54.7 mp0 -127.73 118.11 23.18 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 p -79.43 153.73 29.47 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.158 -0.964 . . . . 0.0 108.433 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.4 mtt180 -96.24 134.6 39.15 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.678 HD21 ' HD1' ' A' ' 75' ' ' HIS . 75.3 m-80 -150.05 101.82 3.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.291 -0.881 . . . . 0.0 109.623 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.12 -140.73 44.49 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.9 p -86.44 -7.88 58.07 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.283 -1.128 . . . . 0.0 109.828 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -118.67 110.45 17.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.596 -0.69 . . . . 0.0 109.627 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.03 149.09 29.41 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.678 ' HD1' HD21 ' A' ' 70' ' ' ASN . 81.0 m80 -107.46 129.56 54.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.513 -0.742 . . . . 0.0 109.364 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.6 p -70.62 151.57 44.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.451 -0.781 . . . . 0.0 109.395 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -144.36 156.27 44.16 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.0 pt -138.29 155.02 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.479 -0.763 . . . . 0.0 109.852 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -154.21 146.99 24.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.386 -0.821 . . . . 0.0 108.804 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 69.0 mt -69.05 136.3 52.16 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.218 -0.926 . . . . 0.0 108.634 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 . . . . . 0 N--CA 1.496 1.832 0 O-C-N 121.274 -0.891 . . . . 0.0 109.639 -179.315 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.35 134.94 15.83 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.608 1.539 . . . . 0.0 112.099 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.38 -41.32 96.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.379 -0.826 . . . . 0.0 109.455 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.33 -41.76 72.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.209 -0.932 . . . . 0.0 109.53 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -65.26 -44.51 87.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.15 -0.969 . . . . 0.0 108.635 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 81.3 mtp -62.55 -49.05 76.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.862 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -68.64 -42.89 77.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.001 -1.062 . . . . 0.0 109.829 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -63.2 -48.05 79.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.942 -1.099 . . . . 0.0 109.993 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.0 p -65.93 -40.32 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.09 -1.006 . . . . 0.0 110.223 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.47 -48.66 31.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.094 -1.004 . . . . 0.0 110.74 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.6 mt -62.88 -45.03 99.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 109.495 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -66.37 -32.83 74.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.58 91.61 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.138 -0.977 . . . . 0.0 110.361 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.3 m -117.96 20.15 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.506 -0.746 . . . . 0.0 109.812 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.14 -27.32 66.97 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.056 -1.027 . . . . 0.0 109.662 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 51.21 85.81 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.724 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 25' ' ' GLY . 31.8 t70 52.78 38.8 27.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.07 -1.019 . . . . 0.0 110.499 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 26' ' ' TRP . 4.1 p 62.01 1.24 0.64 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.86 . . . . 0.0 109.688 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 23' ' ' ASP . . . -68.46 76.08 0.27 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.61 ' H ' ' NH2' ' A' ' 79' ' ' ARG . 88.7 m95 40.7 -165.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.896 -0.767 . . . . 0.0 111.216 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.74 133.03 10.85 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -71.38 125.98 28.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 109.577 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.6 tp -54.66 -40.29 68.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 109.265 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -58.53 -43.6 89.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.173 -0.955 . . . . 0.0 109.092 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.28 93.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 109.541 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.95 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.04 -1.037 . . . . 0.0 109.064 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.98 85.71 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.2 t -61.78 -43.37 98.98 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.159 -1.201 . . . . 0.0 109.729 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 72.2 t80 -59.52 -46.7 88.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.278 -0.889 . . . . 0.0 109.549 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.1 mt -63.24 -40.4 97.33 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.287 -0.883 . . . . 0.0 109.209 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.09 -47.86 65.02 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.94 -1.1 . . . . 0.0 109.58 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -63.89 -41.41 97.71 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 109.298 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.417 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 10.5 m120 -89.02 8.39 29.92 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.047 -1.033 . . . . 0.0 109.253 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.476 ' N ' ' O ' ' A' ' 36' ' ' LEU . 45.0 t0 -153.38 78.44 5.74 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.335 -0.853 . . . . 0.0 109.173 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.415 ' O ' ' CB ' ' A' ' 42' ' ' SER . 21.1 Cg_exo -62.96 156.52 53.89 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.35 2.033 . . . . 0.0 111.54 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 41' ' ' PRO . 0.9 OUTLIER 75.05 2.68 4.02 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.719 -0.613 . . . . 0.0 109.373 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -93.2 -71.26 0.66 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 55.16 89.42 0.11 Allowed Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.656 -0.652 . . . . 0.0 109.518 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 49' ' ' GLY . 50.8 Cg_exo -54.37 -36.68 88.0 Favored 'Trans proline' 0 N--CA 1.499 1.801 0 C-N-CA 122.246 1.964 . . . . 0.0 111.238 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -58.96 -44.7 91.51 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -47.83 -32.71 6.42 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.345 -0.847 . . . . 0.0 109.921 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 25.5 p-90 -134.37 31.89 3.43 Favored 'General case' 0 N--CA 1.504 2.225 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 51' ' ' GLY . . . -61.9 -76.86 0.22 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.468 ' ND1' ' O ' ' A' ' 50' ' ' HIS . 62.7 t-80 55.19 3.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.686 -0.89 . . . . 0.0 110.447 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 49' ' ' GLY . . . 74.35 -18.29 2.2 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.502 HH11 ' HG3' ' A' ' 52' ' ' ARG . 8.9 ptm180 -61.08 -3.92 0.95 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.126 -1.22 . . . . 0.0 109.195 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 51' ' ' GLY . 58.8 tp -62.67 -44.25 96.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.315 -0.866 . . . . 0.0 108.806 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.6 p -65.13 -34.83 79.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.334 -0.854 . . . . 0.0 109.353 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -74.87 -33.53 62.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.024 . . . . 0.0 109.507 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.77 -46.79 86.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.873 -1.142 . . . . 0.0 109.585 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.0 -23.9 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.376 -0.827 . . . . 0.0 109.826 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.16 -32.1 71.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.28 -0.888 . . . . 0.0 109.433 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -70.88 -1.91 13.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.141 -0.974 . . . . 0.0 109.616 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -103.65 122.8 45.77 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.427 -0.795 . . . . 0.0 108.908 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.483 ' C ' ' H ' ' A' ' 63' ' ' LEU . 40.2 p-10 -73.89 -37.5 64.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.414 -0.804 . . . . 0.0 111.582 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.458 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 50.2 p90 -72.19 19.29 0.07 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.653 -1.28 . . . . 0.0 110.976 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.483 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.0 mt -137.62 125.86 23.14 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.442 -0.786 . . . . 0.0 108.974 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.4 m -92.5 133.56 35.81 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.01 130.87 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.33 0 CA-C-O 121.545 0.688 . . . . 0.0 109.513 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -149.7 144.4 26.07 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.21 122.68 47.01 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.457 -0.777 . . . . 0.0 109.139 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.9 m -78.77 149.54 32.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 109.403 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.57 126.24 33.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.609 -0.682 . . . . 0.0 109.294 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.55 ' ND2' ' NE2' ' A' ' 75' ' ' HIS . 51.4 t30 -149.91 89.62 1.62 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.335 -0.853 . . . . 0.0 109.883 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.36 -140.67 46.67 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.0 p -86.5 -7.55 58.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.197 -1.178 . . . . 0.0 109.992 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -102.98 122.8 45.36 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.3 mt -87.15 129.4 34.95 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.55 ' NE2' ' ND2' ' A' ' 70' ' ' ASN . 17.4 m-70 -98.12 116.79 31.07 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.388 -0.82 . . . . 0.0 109.228 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.7 m -71.96 144.37 48.92 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.499 -0.751 . . . . 0.0 109.186 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -143.39 150.99 39.88 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.22 149.58 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.609 -0.682 . . . . 0.0 109.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.61 ' NH2' ' H ' ' A' ' 26' ' ' TRP . 6.9 ptp180 -155.42 156.49 35.43 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.5 137.22 46.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.893 . . . . 0.0 109.26 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 . . . . . 0 C--N 1.301 -1.517 0 O-C-N 121.527 -0.733 . . . . 0.0 109.935 -179.974 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 . . . . . 0 N--CA 1.495 1.776 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -49.52 134.68 32.95 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 121.412 1.408 . . . . 0.0 112.148 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.56 -41.35 96.36 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 108.989 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -56.39 -48.27 77.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 109.81 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.11 -39.2 92.77 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.193 -0.942 . . . . 0.0 109.477 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.5 ttt -62.78 -53.02 60.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -69.94 -41.82 74.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.914 -1.116 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.6 -47.57 83.2 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.078 -1.014 . . . . 0.0 109.855 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.8 m -62.26 -44.27 96.92 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.291 -0.881 . . . . 0.0 110.208 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.52 -48.12 50.8 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.055 -1.028 . . . . 0.0 110.548 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -62.78 -44.1 99.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.026 -1.046 . . . . 0.0 109.461 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.25 -35.33 80.13 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.176 -0.953 . . . . 0.0 110.01 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.43 -57.9 8.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.067 -1.021 . . . . 0.0 110.621 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.4 m -97.06 27.26 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 121.323 -0.861 . . . . 0.0 110.063 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.408 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -55.39 -32.78 62.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.961 -1.087 . . . . 0.0 110.08 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.632 ' CG ' HH11 ' A' ' 22' ' ' ARG . 9.4 mtt85 48.65 -94.93 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.973 -1.079 . . . . 0.0 110.096 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' N ' ' O ' ' A' ' 21' ' ' ALA . 67.8 t0 -62.69 -53.27 56.94 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.273 -0.892 . . . . 0.0 111.189 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.9 p -171.39 -160.24 0.17 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.199 -0.938 . . . . 0.0 109.567 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -50.21 -17.78 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -82.43 136.59 34.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.161 -1.2 . . . . 0.0 108.974 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.88 145.34 31.54 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.47 -0.769 . . . . 0.0 109.328 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.02 131.53 48.92 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.27 -0.894 . . . . 0.0 109.551 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 tp -57.2 -39.88 76.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.244 -0.91 . . . . 0.0 109.554 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -57.74 -41.4 81.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.112 -0.993 . . . . 0.0 109.201 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.373 -0.83 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.18 -48.46 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 109.477 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.66 -48.02 84.66 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.91 -43.85 97.69 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.291 -1.123 . . . . 0.0 109.638 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.539 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 87.6 t80 -60.35 -46.36 90.2 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.186 -0.946 . . . . 0.0 109.263 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.53 -38.92 92.99 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.42 -0.8 . . . . 0.0 109.173 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.34 -46.84 76.38 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.536 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -64.47 -44.17 91.87 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.897 . . . . 0.0 109.517 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.539 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.4 m-80 -65.4 -40.14 93.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.864 . . . . 0.0 110.362 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -90.76 167.15 16.97 Favored Pre-proline 0 N--CA 1.505 2.293 0 O-C-N 121.317 -0.865 . . . . 0.0 108.979 -179.265 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.08 -45.06 43.8 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.497 1.465 . . . . 0.0 111.252 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 t -179.03 88.67 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.426 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 36.4 t80 -61.38 174.4 0.73 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.336 -0.852 . . . . 0.0 109.05 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -133.4 76.18 68.43 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.485 -0.759 . . . . 0.0 110.15 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.56 -37.96 94.6 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.194 1.929 . . . . 0.0 111.932 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -60.65 -37.24 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.606 -0.684 . . . . 0.0 109.233 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 49' ' ' GLY . 58.6 t-20 -59.61 -40.02 86.15 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -82.55 31.47 0.41 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.378 -0.826 . . . . 0.0 108.993 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 67.92 169.75 4.98 Favored Glycine 0 N--CA 1.495 2.586 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -68.16 -39.42 82.62 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.462 -1.022 . . . . 0.0 109.652 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.6 8.51 2.57 Favored Glycine 0 N--CA 1.504 3.194 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -68.1 -12.27 60.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.169 -1.195 . . . . 0.0 108.639 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.79 -40.38 94.99 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.431 ' HG ' ' N ' ' A' ' 55' ' ' GLN . 79.1 p -60.79 -36.95 80.28 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.349 -0.844 . . . . 0.0 109.032 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.431 ' N ' ' HG ' ' A' ' 54' ' ' SER . 14.6 mm100 -69.37 -36.81 77.22 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.377 -0.827 . . . . 0.0 110.12 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.1 tpt -61.22 -47.81 84.41 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.897 -1.127 . . . . 0.0 109.871 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.45 -25.46 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.119 -0.988 . . . . 0.0 109.394 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -62.4 -32.55 73.39 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.374 -0.829 . . . . 0.0 109.513 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -64.04 -33.44 75.76 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.411 -0.806 . . . . 0.0 108.874 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.02 142.53 47.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.391 -0.818 . . . . 0.0 109.433 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.469 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.7 p-10 -90.62 -34.62 15.39 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.282 -0.886 . . . . 0.0 111.273 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.405 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 40.4 p90 -73.04 16.27 0.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.678 -1.264 . . . . 0.0 110.396 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.469 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.1 mt -134.06 127.2 31.73 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.1 m -95.16 134.8 37.49 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -118.04 131.27 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 121.608 -0.682 . . . . 0.0 109.468 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -140.24 137.42 34.25 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.461 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 40.3 mp0 -94.57 134.78 36.76 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -0.793 . . . . 0.0 109.291 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.7 m -117.37 129.92 56.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.644 -0.66 . . . . 0.0 109.346 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -75.11 138.44 42.08 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.775 -1.203 . . . . 0.0 109.735 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -151.0 92.05 1.77 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.72 -140.71 48.05 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.8 p -84.43 -6.21 59.36 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.44 -1.035 . . . . 0.0 110.356 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -123.2 97.72 5.55 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.508 -0.745 . . . . 0.0 109.852 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.9 134.52 50.96 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -103.41 128.35 50.56 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.53 -0.731 . . . . 0.0 109.677 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.5 t -71.29 154.35 41.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.633 -0.667 . . . . 0.0 109.601 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -136.56 145.65 45.23 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.3 pt -132.35 157.1 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -143.51 147.54 34.64 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.79 119.24 24.1 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.24 -0.912 . . . . 0.0 109.765 -178.82 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.55 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.815 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 34.7 Cg_exo -61.52 138.79 78.07 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.217 1.945 . . . . 0.0 111.738 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.436 ' CD2' ' N ' ' A' ' 9' ' ' LEU . 3.6 mm? -64.96 -41.96 95.02 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.184 -0.948 . . . . 0.0 108.991 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -65.22 -45.64 83.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 109.86 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -64.64 -35.84 82.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.66 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.5 ttt -61.71 -61.43 2.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.29 -0.881 . . . . 0.0 109.852 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -66.86 -40.31 87.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.069 -1.019 . . . . 0.0 110.256 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.9 m -61.75 -46.07 91.21 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.774 -1.204 . . . . 0.0 109.883 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.5 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.039 -1.038 . . . . 0.0 109.966 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.72 -46.75 62.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.479 ' O ' ' N ' ' A' ' 21' ' ' ALA . 98.1 mt -62.56 -45.16 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 109.509 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -67.6 -32.51 73.3 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.093 -1.004 . . . . 0.0 109.093 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.08 -25.71 67.92 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.29 -0.882 . . . . 0.0 109.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.1 m -131.89 19.43 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.423 -0.798 . . . . 0.0 110.335 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.86 -24.75 66.16 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.887 -1.133 . . . . 0.0 108.893 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 51.81 178.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.472 -0.768 . . . . 0.0 110.267 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -68.73 -18.67 64.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.617 -0.677 . . . . 0.0 110.038 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.7 m -74.45 -6.11 46.42 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.901 -1.124 . . . . 0.0 109.469 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -52.51 1.97 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.448 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 96.5 m95 -61.73 178.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -1.13 . . . . 0.0 109.274 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.83 133.13 14.5 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -73.49 132.07 42.49 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.248 -0.907 . . . . 0.0 109.354 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 tp -54.76 -38.45 67.21 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.238 -0.914 . . . . 0.0 109.546 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -57.94 -44.9 87.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.908 -1.12 . . . . 0.0 109.34 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.07 -41.01 99.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.122 -0.986 . . . . 0.0 109.414 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 82.5 t -62.36 -48.14 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.33 -49.17 76.78 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.9 m -61.32 -43.01 99.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.133 -1.216 . . . . 0.0 109.813 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.566 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 69.6 t80 -60.79 -47.35 86.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.253 -0.905 . . . . 0.0 109.385 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 40' ' ' ASP . 80.5 mt -63.0 -40.74 98.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.114 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 41' ' ' PRO . . . -57.51 -48.22 79.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.116 -0.99 . . . . 0.0 109.247 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -61.76 -41.24 97.44 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.204 -0.935 . . . . 0.0 109.132 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.566 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.2 m-80 -80.23 -9.81 59.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.277 -0.889 . . . . 0.0 109.269 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.0 t0 -164.57 71.31 1.55 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.266 -0.896 . . . . 0.0 109.457 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.447 ' N ' ' O ' ' A' ' 37' ' ' ALA . 52.4 Cg_exo -57.14 -30.71 88.07 Favored 'Trans proline' 0 N--CA 1.498 1.788 0 C-N-CA 122.595 2.197 . . . . 0.0 111.489 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -57.11 -13.58 3.08 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.606 -0.684 . . . . 0.0 110.183 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -92.22 -55.51 3.4 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 t0 54.44 85.56 0.19 Allowed Pre-proline 0 N--CA 1.498 1.94 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -54.77 -49.15 17.72 Favored 'Trans proline' 0 N--CA 1.499 1.804 0 C-N-CA 122.328 2.019 . . . . 0.0 112.511 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.461 HH11 ' HG2' ' A' ' 46' ' ' ARG . 66.1 mtp85 -53.19 -52.97 57.11 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.446 -0.784 . . . . 0.0 109.36 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -66.57 -35.09 79.36 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 19.7 t90 -79.34 3.39 18.35 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.193 -0.942 . . . . 0.0 109.777 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.8 126.95 1.01 Allowed Glycine 0 N--CA 1.497 2.714 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -65.91 -45.35 82.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.091 -1.241 . . . . 0.0 109.068 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.8 1.91 0.72 Allowed Glycine 0 N--CA 1.5 2.938 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -66.03 -3.29 5.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.236 . . . . 0.0 109.278 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.2 tp -66.25 -41.6 89.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.122 -0.986 . . . . 0.0 108.668 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 t -59.8 -44.17 94.11 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.438 -0.789 . . . . 0.0 109.66 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -68.09 -30.47 69.65 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.221 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -63.36 -46.97 84.09 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.179 -0.95 . . . . 0.0 109.83 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.75 -21.09 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.159 -0.963 . . . . 0.0 109.788 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -59.42 -31.99 69.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.147 -0.971 . . . . 0.0 109.557 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -73.47 -3.23 26.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.093 -1.004 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.7 mt -100.22 110.23 22.48 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.368 -0.833 . . . . 0.0 108.862 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.475 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.7 t0 -66.12 -37.36 85.53 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 111.523 -179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -71.48 20.03 0.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.727 -1.233 . . . . 0.0 110.981 -178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.2 mt -139.34 127.89 23.05 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.223 -0.923 . . . . 0.0 108.954 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.2 m -90.13 133.2 35.02 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.355 -0.84 . . . . 0.0 109.017 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -120.94 130.73 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.675 -0.641 . . . . 0.0 109.45 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.448 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.6 mt-30 -144.73 153.2 41.44 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.461 -0.774 . . . . 0.0 109.077 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -103.79 144.67 31.17 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.418 -0.801 . . . . 0.0 110.265 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 132.14 44.54 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.638 0.732 . . . . 0.0 109.273 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.633 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -70.21 131.59 44.45 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.542 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 39.7 t-20 -148.69 104.72 3.5 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 120.845 -1.159 . . . . 0.0 109.347 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.28 -140.84 45.45 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 32.1 t -85.22 -3.43 58.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.331 -1.099 . . . . 0.0 110.563 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -134.18 120.39 20.01 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.25 -0.906 . . . . 0.0 109.605 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.75 140.05 58.83 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.678 -0.809 . . . . 0.0 108.828 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.542 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.7 m-70 -102.46 124.32 47.8 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.3 p -71.44 156.63 39.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.491 -0.756 . . . . 0.0 109.035 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.45 149.3 39.07 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.9 pt -142.26 153.92 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.53 -0.731 . . . . 0.0 109.685 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -152.32 152.68 32.41 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.875 . . . . 0.0 108.801 178.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.74 135.08 49.33 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.225 -0.922 . . . . 0.0 109.825 -179.686 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -55.46 122.66 12.13 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.855 1.703 . . . . 0.0 112.05 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.06 -39.6 93.49 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.647 -0.658 . . . . 0.0 109.527 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -53.84 -48.37 70.01 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.349 -0.845 . . . . 0.0 109.831 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.01 -40.4 94.87 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.221 -0.924 . . . . 0.0 109.341 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.8 ttm -61.85 -51.53 67.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.099 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -70.29 -40.37 74.31 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -61.82 -48.36 80.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.11 -0.994 . . . . 0.0 109.705 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.3 m -62.57 -42.9 99.84 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.155 -0.966 . . . . 0.0 110.262 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.02 -48.29 58.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.035 -1.041 . . . . 0.0 111.034 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.435 ' O ' ' N ' ' A' ' 21' ' ' ALA . 95.3 mt -63.1 -45.35 98.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.093 -1.004 . . . . 0.0 109.789 -178.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.2 -34.24 77.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.706 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.05 -39.1 93.72 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 110.066 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.604 ' C ' ' H ' ' A' ' 22' ' ' ARG . 14.8 m -114.02 16.25 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 121.614 -0.679 . . . . 0.0 110.321 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -63.0 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.68 -1.263 . . . . 0.0 110.041 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.604 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.0 mtp180 -61.13 -142.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.028 -1.045 . . . . 0.0 109.912 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 54.12 -88.5 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.133 -0.979 . . . . 0.0 109.17 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' ARG . 88.5 p -160.58 72.31 0.46 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.74 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.14 -60.88 1.04 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -53.78 178.63 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.324 -1.104 . . . . 0.0 109.821 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -152.8 129.38 10.75 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.13 127.03 29.99 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.141 -0.974 . . . . 0.0 109.47 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.3 tp -57.45 -39.2 75.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.4 -0.812 . . . . 0.0 109.155 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.7 m -57.11 -42.05 80.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.0 109.262 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.51 91.35 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.143 -0.973 . . . . 0.0 109.322 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.9 -47.95 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.17 -0.956 . . . . 0.0 109.224 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.98 -49.79 69.11 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -62.22 -42.33 99.21 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -1.132 . . . . 0.0 109.611 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.3 t80 -60.75 -46.43 90.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.231 -0.918 . . . . 0.0 109.446 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 mt -63.15 -40.01 96.33 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.122 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 109.275 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.04 -43.13 96.46 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 109.595 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 82.9 m-20 -90.51 4.66 50.49 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.242 -0.911 . . . . 0.0 109.136 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 36' ' ' LEU . 21.8 t70 -168.23 77.24 0.85 Allowed Pre-proline 0 N--CA 1.489 1.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.44 -28.14 52.76 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.137 1.891 . . . . 0.0 111.331 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.1 t -63.32 -15.53 57.63 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.462 -0.773 . . . . 0.0 109.587 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -75.01 131.3 40.53 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.227 -0.921 . . . . 0.0 109.085 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 18.6 p30 -138.45 83.07 21.5 Favored Pre-proline 0 N--CA 1.5 2.059 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -58.7 -24.78 72.66 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 45.2 mmm-85 -67.42 -42.52 83.06 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.846 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -72.77 -12.13 60.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.291 -0.88 . . . . 0.0 109.153 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -81.7 -2.83 51.89 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.21 -0.931 . . . . 0.0 109.581 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.12 13.81 7.48 Favored Glycine 0 N--CA 1.508 3.484 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.413 ' C ' ' H ' ' A' ' 52' ' ' ARG . 17.0 m80 56.24 110.73 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.653 -0.91 . . . . 0.0 110.736 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.75 -6.47 12.35 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.413 ' H ' ' C ' ' A' ' 50' ' ' HIS . 6.5 tpp180 -66.93 -7.75 24.41 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.386 -1.067 . . . . 0.0 109.034 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.35 -42.79 99.68 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -62.44 -43.61 98.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 109.539 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 25.9 mp0 -71.54 -27.9 63.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.312 -0.868 . . . . 0.0 109.395 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 44.7 ttp -67.67 -47.12 70.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.096 -1.002 . . . . 0.0 109.804 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.4 m -72.69 -14.85 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.068 -1.02 . . . . 0.0 109.702 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.32 -26.82 65.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.425 -0.797 . . . . 0.0 109.83 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -80.59 -3.69 51.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.05 -1.031 . . . . 0.0 109.418 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -99.07 110.22 22.84 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.488 ' C ' ' H ' ' A' ' 63' ' ' LEU . 92.2 m-20 -64.58 -39.02 92.99 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.403 -0.811 . . . . 0.0 111.325 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -70.27 21.16 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.718 -1.239 . . . . 0.0 111.199 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.488 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.8 mt -138.21 131.9 31.01 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.192 -0.942 . . . . 0.0 108.978 178.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 86.8 m -93.43 134.83 35.27 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.322 -0.861 . . . . 0.0 108.689 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.6 t -122.62 131.17 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.473 -0.767 . . . . 0.0 109.244 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.0 tt0 -150.68 153.68 36.05 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.6 pm0 -149.92 154.22 37.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.292 -0.88 . . . . 0.0 109.066 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 70' ' ' ASN . 45.1 t -143.85 132.23 22.09 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.452 -0.78 . . . . 0.0 109.35 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.525 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.8 OUTLIER -64.55 84.0 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' SER . 98.2 m-20 -98.6 142.94 29.55 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.382 -0.824 . . . . 0.0 109.544 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.53 -142.78 42.72 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -100.72 9.6 42.23 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.671 -0.899 . . . . 0.0 109.585 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.442 ' O ' ' ND1' ' A' ' 75' ' ' HIS . 36.6 ttmt -138.16 139.1 39.21 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.34 -0.85 . . . . 0.0 109.971 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.3 tp -66.44 128.95 38.18 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.442 ' ND1' ' O ' ' A' ' 73' ' ' LYS . 64.6 m80 -108.24 104.66 14.11 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.7 m -85.31 150.14 24.97 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.483 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -144.79 149.26 35.17 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.367 -0.833 . . . . 0.0 108.951 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.8 pt -135.08 152.25 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.725 -0.609 . . . . 0.0 109.467 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -141.04 155.81 46.12 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.48 94.31 6.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.877 . . . . 0.0 108.886 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 . . . . . 0 N--CA 1.505 2.309 0 CA-C-O 121.533 0.682 . . . . 0.0 111.03 179.123 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 m170 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -44.85 129.87 9.78 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.651 1.567 . . . . 0.0 112.086 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.99 -41.77 95.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.493 -0.755 . . . . 0.0 109.361 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.462 ' NE2' ' OG1' ' A' ' 14' ' ' THR . 19.9 tm0? -56.33 -48.77 76.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.326 -0.859 . . . . 0.0 109.41 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.01 -34.66 78.21 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttt -62.62 -52.56 62.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.301 -0.874 . . . . 0.0 110.328 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.45 -42.01 75.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.908 -1.12 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.462 ' OG1' ' NE2' ' A' ' 10' ' ' GLN . 97.0 m -61.63 -44.45 96.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.845 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.1 t -61.67 -45.02 95.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.087 -1.008 . . . . 0.0 110.218 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.3 -46.11 51.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.261 -0.899 . . . . 0.0 110.897 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.05 -45.55 98.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.165 -0.959 . . . . 0.0 109.902 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.22 -32.81 72.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.245 -0.909 . . . . 0.0 109.834 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.13 -40.25 94.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.255 -0.903 . . . . 0.0 110.391 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.499 ' C ' ' H ' ' A' ' 22' ' ' ARG . 10.6 m -100.05 6.31 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 O-C-N 121.253 -0.905 . . . . 0.0 109.742 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.0 8.5 0.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.032 -1.043 . . . . 0.0 109.461 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.499 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.5 mtp180 -61.83 -40.5 95.51 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.078 -1.014 . . . . 0.0 109.859 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' O ' ' N ' ' A' ' 25' ' ' GLY . 37.0 p-10 -73.89 121.43 20.93 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.076 -1.015 . . . . 0.0 109.549 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' A' ' 25' ' ' GLY . 96.3 p 47.38 -91.78 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.389 -0.82 . . . . 0.0 110.445 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 23' ' ' ASP . . . -159.41 -59.04 0.01 OUTLIER Glycine 0 N--CA 1.494 2.558 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.432 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 81.9 m95 -55.27 -177.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.396 -1.061 . . . . 0.0 109.872 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.08 135.06 32.19 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.636 -0.665 . . . . 0.0 109.239 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -71.31 134.83 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.257 -0.902 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 tp -55.6 -40.86 72.6 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 109.287 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.637 ' HG ' HH22 ' A' ' 46' ' ' ARG . 40.0 t -59.57 -43.8 93.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.112 -0.992 . . . . 0.0 108.991 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.15 86.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.237 -0.914 . . . . 0.0 109.664 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 73.5 t -61.72 -48.86 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.09 -1.006 . . . . 0.0 109.132 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.15 92.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.41 ' HB2' HH21 ' A' ' 46' ' ' ARG . 7.4 t -61.68 -44.28 97.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.859 -1.377 . . . . 0.0 109.832 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.547 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 71.6 t80 -57.98 -43.91 86.83 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.247 -0.908 . . . . 0.0 109.409 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.3 -40.3 96.98 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.337 -0.852 . . . . 0.0 108.992 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.089 -1.007 . . . . 0.0 109.192 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -61.04 -42.52 98.63 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.303 -0.873 . . . . 0.0 109.497 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.547 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.1 m-80 -83.01 -6.07 59.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.275 -0.891 . . . . 0.0 108.714 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -153.69 74.01 6.51 Favored Pre-proline 0 N--CA 1.495 1.799 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.25 -35.31 73.51 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.288 1.992 . . . . 0.0 111.204 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.6 p -66.57 -10.98 50.88 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.539 -0.725 . . . . 0.0 109.415 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -88.36 148.32 24.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.277 -0.889 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -129.45 78.18 76.1 Favored Pre-proline 0 N--CA 1.502 2.145 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 49' ' ' GLY . 41.7 Cg_endo -78.21 -27.3 5.6 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.724 1.616 . . . . 0.0 110.83 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.637 HH22 ' HG ' ' A' ' 30' ' ' SER . 25.2 mmt180 -65.02 -45.25 86.3 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.439 -0.788 . . . . 0.0 109.192 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -48.6 -30.85 5.81 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.319 -0.863 . . . . 0.0 110.295 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 15.0 p-90 -135.62 25.19 3.42 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.252 -0.905 . . . . 0.0 109.829 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -87.43 -11.54 68.81 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -66.5 -40.74 89.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.006 -1.291 . . . . 0.0 109.425 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.646 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . -139.89 -147.94 5.11 Favored Glycine 0 N--CA 1.502 3.073 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 49.0 -74.84 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 CA-C-N 117.53 0.665 . . . . 0.0 110.535 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.646 ' N ' ' O ' ' A' ' 51' ' ' GLY . 64.7 tp -51.18 -41.67 60.36 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.098 -1.001 . . . . 0.0 108.571 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.1 p -63.98 -29.66 70.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.484 -0.76 . . . . 0.0 109.137 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -85.87 -29.3 23.8 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.265 -0.897 . . . . 0.0 109.562 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.7 mtt -63.61 -41.4 98.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.158 -0.964 . . . . 0.0 109.15 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.7 m -61.47 -41.42 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.242 -0.911 . . . . 0.0 108.93 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.65 -31.98 72.36 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.692 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -89.56 -2.38 58.32 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.109 -0.994 . . . . 0.0 110.417 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 62' ' ' PHE . 6.3 mt -88.09 5.4 41.32 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.203 -0.936 . . . . 0.0 109.196 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.6 t0 56.55 -75.77 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.781 -0.574 . . . . 0.0 111.793 178.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 60' ' ' LEU . 47.6 p90 -65.52 26.95 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.623 -1.298 . . . . 0.0 111.848 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 61' ' ' ASP . 1.2 mm? -124.86 126.81 46.15 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 120.948 -1.095 . . . . 0.0 108.351 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.1 m -88.45 141.93 28.13 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.54 131.14 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.503 -0.748 . . . . 0.0 109.371 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.432 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -145.53 155.3 42.99 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 38.8 mp0 -114.58 123.95 50.63 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 89.8 p -109.44 150.92 27.38 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 130.54 34.76 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.589 0.709 . . . . 0.0 109.367 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -152.1 112.81 4.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.414 -0.804 . . . . 0.0 109.263 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.41 -144.64 47.41 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.4 p -92.92 1.92 57.05 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.509 -0.994 . . . . 0.0 109.864 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -123.71 135.94 54.16 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.487 -0.758 . . . . 0.0 109.935 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 73.6 mt -75.41 132.42 40.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -104.89 117.03 33.02 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.569 -0.707 . . . . 0.0 109.114 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.0 t -68.12 139.28 56.17 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.371 -0.83 . . . . 0.0 109.476 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -126.26 143.74 51.04 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.9 pt -135.37 158.44 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.742 -0.599 . . . . 0.0 110.07 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -147.98 139.8 23.94 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.38 106.76 0.57 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 109.957 -179.15 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.67 143.47 95.01 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.317 2.012 . . . . 0.0 112.192 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -63.8 -41.2 97.96 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.88 -39.6 81.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.259 -0.901 . . . . 0.0 109.255 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -61.82 -43.54 98.65 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.3 -0.875 . . . . 0.0 109.129 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.2 mtt -63.89 -46.76 83.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.208 -0.933 . . . . 0.0 109.868 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -69.74 -44.12 70.91 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.228 -0.92 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.6 m -63.28 -47.2 83.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.937 . . . . 0.0 110.147 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -66.5 -40.27 89.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 110.133 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.059 -1.026 . . . . 0.0 110.603 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -62.71 -44.45 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.349 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.73 -33.54 75.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 110.063 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 -58.92 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.134 -0.979 . . . . 0.0 110.467 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -98.31 29.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.314 -0.866 . . . . 0.0 109.453 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -48.91 -33.6 11.11 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.011 -1.056 . . . . 0.0 109.659 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.695 ' HG2' HH11 ' A' ' 22' ' ' ARG . 40.8 ttp85 51.92 -87.48 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.466 -0.771 . . . . 0.0 110.605 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 21' ' ' ALA . 95.9 m-20 -60.74 -88.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.892 -1.13 . . . . 0.0 109.989 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.424 ' C ' ' H ' ' A' ' 26' ' ' TRP . 31.6 t -167.99 97.95 0.45 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.099 -1.001 . . . . 0.0 109.363 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.5 -25.69 2.38 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.424 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.2 m95 -91.51 142.69 27.38 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.209 -1.171 . . . . 0.0 109.607 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.48 141.7 29.75 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.305 -0.872 . . . . 0.0 108.945 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -67.54 130.36 42.8 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.291 -0.881 . . . . 0.0 109.728 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.72 -39.47 71.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.349 -0.844 . . . . 0.0 109.225 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 t -58.6 -44.0 89.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.098 -1.001 . . . . 0.0 109.173 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.32 87.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.154 -0.966 . . . . 0.0 109.684 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.09 -48.98 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.078 -1.014 . . . . 0.0 109.387 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.47 -44.39 97.73 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.429 ' HG ' ' N ' ' A' ' 35' ' ' TYR . 78.0 p -69.64 -40.33 76.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 109.804 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.513 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 70.7 t80 -61.71 -48.52 80.39 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.249 -0.907 . . . . 0.0 109.637 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.0 mt -63.09 -42.14 99.55 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.232 -0.918 . . . . 0.0 108.954 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.64 87.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.907 . . . . 0.0 109.084 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -64.97 -42.85 94.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 109.383 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.513 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.5 m-80 -84.78 -4.64 59.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.171 -0.955 . . . . 0.0 109.352 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 36' ' ' LEU . 7.9 m-20 -154.74 74.24 5.78 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.278 -0.889 . . . . 0.0 108.884 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.0 -35.18 80.09 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.377 2.051 . . . . 0.0 111.286 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.8 t -65.4 -12.47 52.58 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.47 136.12 56.75 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.301 -0.874 . . . . 0.0 108.784 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.438 ' O ' ' ND2' ' A' ' 47' ' ' ASN . 66.2 m-20 -120.45 92.26 47.41 Favored Pre-proline 0 N--CA 1.502 2.141 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.17 -8.31 21.85 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 121.175 1.25 . . . . 0.0 111.49 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.676 HH11 ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -66.85 -41.9 86.63 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.566 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.556 ' O ' ' NH2' ' A' ' 52' ' ' ARG . 17.1 p30 -70.48 -22.09 62.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.528 -0.733 . . . . 0.0 109.549 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.523 ' CE3' ' SD ' ' A' ' 56' ' ' MET . 89.7 m95 -93.61 3.81 54.93 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.131 -0.981 . . . . 0.0 109.112 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.35 138.74 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -68.22 -36.27 79.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.139 -1.212 . . . . 0.0 110.267 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.62 -34.83 5.87 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.556 ' NH2' ' O ' ' A' ' 47' ' ' ASN . 46.3 ttp180 -63.93 -17.51 63.31 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.547 -0.973 . . . . 0.0 109.247 -178.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.3 tp -62.9 -43.05 99.83 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -64.83 -27.6 68.99 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.499 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -80.86 -34.28 33.86 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.139 -0.976 . . . . 0.0 109.4 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.523 ' SD ' ' CE3' ' A' ' 48' ' ' TRP . 47.3 ttp -61.48 -45.75 92.93 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -60.94 -31.3 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.28 -0.888 . . . . 0.0 109.487 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -64.6 -30.65 71.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.349 -0.844 . . . . 0.0 109.896 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -86.94 -7.04 58.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.998 -1.064 . . . . 0.0 110.164 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.7 mt -101.36 127.08 48.16 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.322 -0.861 . . . . 0.0 109.051 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' CG ' ' A' ' 62' ' ' PHE . 97.3 m-20 -65.24 -168.91 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.244 -0.91 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CG ' ' O ' ' A' ' 61' ' ' ASP . 54.5 p90 42.89 16.51 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 122.028 -0.42 . . . . 0.0 111.427 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -132.83 116.37 16.44 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.247 -0.908 . . . . 0.0 108.792 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.1 m -91.98 141.02 29.08 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.5 t -114.84 130.01 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-O 121.525 0.679 . . . . 0.0 109.621 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -154.23 143.74 21.51 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -108.92 152.25 25.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.646 -0.659 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.5 m -127.38 131.37 50.34 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.566 ' HD3' ' N ' ' A' ' 69' ' ' ARG . 0.1 OUTLIER -77.52 136.63 38.34 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.462 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.413 HD21 ' HD1' ' A' ' 75' ' ' HIS . 87.4 m-20 -149.56 101.2 3.07 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.154 -0.966 . . . . 0.0 109.367 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.73 -141.77 47.81 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.0 p -86.97 -3.97 59.13 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.488 -1.007 . . . . 0.0 109.953 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -115.71 121.81 43.62 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.675 -0.641 . . . . 0.0 110.143 -179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 tt -82.46 130.11 35.04 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.413 ' HD1' HD21 ' A' ' 70' ' ' ASN . 38.0 m80 -110.22 124.55 51.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.517 -0.739 . . . . 0.0 109.694 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.5 m -72.01 151.92 42.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.518 -0.739 . . . . 0.0 109.294 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -138.78 151.74 47.33 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.1 pt -137.17 156.45 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.623 0.725 . . . . 0.0 109.525 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -157.81 151.04 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.1 mt -70.33 139.52 52.03 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.221 -0.925 . . . . 0.0 109.935 -179.34 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.53 ' NE2' ' SD ' ' A' ' 12' ' ' MET . 61.4 t60 . . . . . 0 N--CA 1.497 1.905 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.42 142.68 98.66 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.063 1.842 . . . . 0.0 111.752 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.23 -43.34 95.22 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.17 -0.956 . . . . 0.0 109.221 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -65.03 -45.36 85.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.39 -0.819 . . . . 0.0 109.4 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.49 -30.39 70.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.352 -0.842 . . . . 0.0 109.406 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.53 ' SD ' ' NE2' ' A' ' 7' ' ' HIS . 20.8 ttt -61.33 -66.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.307 -0.871 . . . . 0.0 109.803 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.32 -41.94 96.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.0 110.157 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.07 -46.32 89.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.963 -1.086 . . . . 0.0 109.862 -179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.4 m -61.27 -44.69 96.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.021 -1.049 . . . . 0.0 110.201 -179.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.29 -43.55 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.161 -0.962 . . . . 0.0 110.529 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.38 -45.21 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.195 -0.94 . . . . 0.0 109.677 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -67.91 -35.39 78.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.327 -0.858 . . . . 0.0 109.848 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.74 -38.31 90.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.193 -0.942 . . . . 0.0 110.113 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.52 ' C ' ' H ' ' A' ' 22' ' ' ARG . 8.3 m -98.4 3.99 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 121.345 -0.847 . . . . 0.0 109.566 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 14.47 0.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.049 -1.032 . . . . 0.0 109.55 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.52 ' H ' ' C ' ' A' ' 20' ' ' VAL . 7.2 mtp180 -46.85 164.41 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.143 -0.973 . . . . 0.0 110.684 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -48.66 96.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.574 0.702 . . . . 0.0 110.117 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.7 m -164.77 -70.67 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.362 -0.836 . . . . 0.0 108.87 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 159.52 120.58 0.57 Allowed Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 24.7 m95 45.87 -121.85 1.06 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.552 -0.97 . . . . 0.0 109.995 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -167.45 117.44 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.046 -1.034 . . . . 0.0 108.762 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.57 131.63 49.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.5 -38.28 66.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.4 -0.813 . . . . 0.0 109.448 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -58.48 -43.35 88.94 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.208 -0.932 . . . . 0.0 108.973 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.36 90.79 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.301 -0.875 . . . . 0.0 109.47 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.42 -49.4 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.158 -0.963 . . . . 0.0 109.217 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.41 -48.38 79.06 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.9 m -62.26 -43.18 99.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.298 -1.119 . . . . 0.0 109.85 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -61.29 -45.26 95.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.337 -0.852 . . . . 0.0 109.685 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.79 -41.14 97.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 109.293 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.19 82.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.245 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -65.39 -45.58 83.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -0.916 . . . . 0.0 109.809 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.432 ' N ' HD21 ' A' ' 39' ' ' ASN . 1.4 m-80 -64.6 -40.51 95.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.154 -0.966 . . . . 0.0 109.651 -179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -88.02 160.08 47.07 Favored Pre-proline 0 N--CA 1.501 2.101 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.394 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.418 ' O ' ' OG ' ' A' ' 42' ' ' SER . 36.3 Cg_endo -62.41 -38.02 56.03 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.917 1.745 . . . . 0.0 111.416 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 41' ' ' PRO . 56.4 m -170.36 76.88 0.08 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.247 -0.908 . . . . 0.0 109.437 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.5 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 37.4 t80 -59.58 169.56 1.28 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.298 -0.876 . . . . 0.0 109.498 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -127.19 76.05 76.53 Favored Pre-proline 0 N--CA 1.503 2.211 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -73.12 -24.02 17.52 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.556 1.504 . . . . 0.0 111.396 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.52 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.5 mtt85 -65.77 -38.77 89.95 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -61.24 -37.82 84.43 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.467 ' HA ' HH21 ' A' ' 52' ' ' ARG . 78.1 m95 -87.78 6.47 35.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.317 -0.864 . . . . 0.0 109.169 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.39 125.01 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -62.63 -12.67 24.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -1.142 . . . . 0.0 109.543 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . -113.87 -43.24 0.81 Allowed Glycine 0 N--CA 1.505 3.281 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.467 HH21 ' HA ' ' A' ' 48' ' ' TRP . 55.3 ttp85 -66.97 -11.47 56.83 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.567 -0.96 . . . . 0.0 108.882 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.66 -42.1 99.43 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.6 p -62.39 -39.08 92.06 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.381 -0.824 . . . . 0.0 109.086 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' O ' ' A' ' 51' ' ' GLY . 3.7 mp0 -72.72 -30.29 64.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.386 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.8 tpt -64.91 -47.43 77.81 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.973 -1.08 . . . . 0.0 109.503 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -72.93 -18.92 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 109.495 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -61.62 -28.79 69.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.456 -0.777 . . . . 0.0 109.789 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -74.52 -1.25 20.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.158 -0.964 . . . . 0.0 109.262 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.8 mt -100.87 119.35 38.55 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.461 -0.775 . . . . 0.0 108.999 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.46 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.1 p-10 -74.11 -36.77 64.25 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.234 -0.917 . . . . 0.0 111.417 -179.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -72.15 19.18 0.07 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.703 -1.248 . . . . 0.0 110.978 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.46 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.8 mt -136.72 129.59 30.79 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.205 179.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 87.6 m -88.51 133.37 34.17 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 108.778 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -125.72 132.81 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.527 -0.733 . . . . 0.0 109.608 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.548 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 3.3 pt20 -153.62 154.52 34.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -104.41 118.01 35.56 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.357 -0.839 . . . . 0.0 108.822 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.452 ' HG ' ' CD ' ' A' ' 77' ' ' GLU . 15.3 m -87.62 152.31 22.27 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.71 134.21 36.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.384 -0.822 . . . . 0.0 109.613 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.552 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 38.1 t-20 -150.72 93.57 1.97 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.006 -1.059 . . . . 0.0 109.185 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.54 -141.67 41.5 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.9 t -87.0 -7.7 57.9 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.29 -1.123 . . . . 0.0 109.895 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -106.34 127.88 53.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.404 -0.81 . . . . 0.0 109.742 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.7 mt -75.15 133.53 41.47 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.552 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -106.89 120.37 41.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -74.98 146.36 41.73 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.498 -0.751 . . . . 0.0 109.271 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.452 ' CD ' ' HG ' ' A' ' 68' ' ' SER . 97.2 mt-10 -142.03 150.24 41.04 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.365 -0.834 . . . . 0.0 108.927 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.0 pt -140.0 157.22 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 121.467 0.651 . . . . 0.0 109.408 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -149.02 147.93 29.13 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 110.94 16.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.018 -1.051 . . . . 0.0 109.247 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.57 -0.706 . . . . 0.0 109.848 -179.429 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 . . . . . 0 N--CA 1.495 1.815 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -45.45 158.03 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.514 0 C-N-CA 121.62 1.546 . . . . 0.0 112.21 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.09 -40.39 95.67 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -54.39 -41.52 69.33 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.25 -0.906 . . . . 0.0 109.294 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -63.32 -42.91 99.02 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.317 -0.864 . . . . 0.0 109.264 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.8 ttt -62.04 -52.21 64.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.009 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -69.14 -42.13 76.38 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.03 -1.043 . . . . 0.0 110.038 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.8 m -62.05 -45.66 92.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.217 -0.927 . . . . 0.0 109.844 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.5 m -60.74 -42.38 97.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 109.7 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.38 95.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 110.354 -179.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 21' ' ' ALA . 96.5 mt -61.93 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.887 -1.133 . . . . 0.0 109.474 -179.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.73 -34.92 78.91 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.198 -0.939 . . . . 0.0 109.565 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.69 -28.59 68.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.102 -0.998 . . . . 0.0 110.08 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 m -136.73 27.93 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.47 -0.769 . . . . 0.0 109.715 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -62.88 -23.26 67.25 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.839 -1.163 . . . . 0.0 109.025 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 55.52 -168.98 0.08 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.247 0.546 . . . . 0.0 110.378 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -58.92 -48.19 82.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.228 -0.92 . . . . 0.0 110.565 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 m -71.65 151.29 43.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.912 -1.117 . . . . 0.0 109.359 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.01 -0.9 66.42 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -100.27 147.66 25.52 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.64 -0.917 . . . . 0.0 109.508 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.0 126.43 39.53 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.404 ' HG3' ' H ' ' A' ' 31' ' ' ALA . 12.8 pt-20 -63.44 138.89 58.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.235 -0.916 . . . . 0.0 109.638 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.31 -38.42 65.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.455 -0.778 . . . . 0.0 109.241 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.6 m -55.91 -44.46 78.27 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 109.628 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.404 ' H ' ' HG3' ' A' ' 28' ' ' GLU . . . -66.38 -38.95 88.69 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.136 -0.978 . . . . 0.0 109.552 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.8 -50.2 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.001 -1.062 . . . . 0.0 109.369 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.09 97.99 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -59.8 -44.21 94.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.179 -1.189 . . . . 0.0 109.493 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -60.97 -47.69 85.29 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.77 -39.67 94.82 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.388 -0.82 . . . . 0.0 109.021 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.7 -45.52 81.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.14 -0.975 . . . . 0.0 109.591 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.1 -48.54 81.29 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.233 -0.917 . . . . 0.0 109.345 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -65.96 -40.19 91.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.309 -0.87 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.03 151.08 75.69 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.223 -0.923 . . . . 0.0 109.185 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.402 ' O ' ' OG ' ' A' ' 42' ' ' SER . 31.8 Cg_endo -62.3 -35.04 75.87 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.697 1.598 . . . . 0.0 111.57 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 41' ' ' PRO . 36.6 m -171.58 80.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.747 -0.596 . . . . 0.0 109.394 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -88.37 -76.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 63.19 91.13 0.08 OUTLIER Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -62.48 -17.55 58.59 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.374 1.383 . . . . 0.0 111.375 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -56.89 -47.46 80.43 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.364 -0.835 . . . . 0.0 109.026 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.454 ' C ' ' H ' ' A' ' 49' ' ' GLY . 98.1 m-20 -62.12 -33.8 75.14 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 27.1 m95 -75.96 26.55 0.12 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.176 -0.953 . . . . 0.0 109.783 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 51' ' ' GLY . . . 69.45 95.82 0.05 OUTLIER Glycine 0 N--CA 1.492 2.429 0 C-N-CA 119.964 -1.112 . . . . 0.0 110.371 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 49.27 -90.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.41 -1.053 . . . . 0.0 110.457 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -157.76 62.9 0.32 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -58.7 -5.7 0.62 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.405 -1.056 . . . . 0.0 109.053 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.9 mp -62.59 -39.48 93.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.3 p -55.89 -33.27 64.46 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.527 -0.733 . . . . 0.0 109.795 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -85.54 -33.58 21.72 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 28.2 ttt -66.03 -43.79 86.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.098 -1.001 . . . . 0.0 109.816 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.62 -22.36 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.187 -0.945 . . . . 0.0 109.81 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -62.55 -21.91 65.93 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.489 -0.757 . . . . 0.0 109.202 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -86.21 6.64 28.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.284 -0.885 . . . . 0.0 109.79 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' PHE . 95.4 mt -93.59 -11.64 31.32 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.11 -0.993 . . . . 0.0 109.41 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.547 ' C ' ' H ' ' A' ' 63' ' ' LEU . 22.9 t0 61.3 -61.56 0.09 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.804 -0.56 . . . . 0.0 111.778 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.497 ' N ' ' O ' ' A' ' 60' ' ' LEU . 49.2 p90 -65.82 22.03 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.66 -1.275 . . . . 0.0 112.138 -178.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.547 ' H ' ' C ' ' A' ' 61' ' ' ASP . 7.6 mt -136.59 133.27 36.15 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.261 -0.899 . . . . 0.0 109.181 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.6 m -88.11 138.1 31.75 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.1 t -123.65 132.71 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -131.4 132.24 44.23 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -120.58 123.14 42.13 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -109.95 134.2 52.36 Favored 'General case' 0 N--CA 1.507 2.395 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -72.78 132.61 43.82 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.706 -1.246 . . . . 0.0 108.512 -179.121 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -148.85 91.24 1.84 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.186 -0.946 . . . . 0.0 109.041 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.02 -135.99 28.44 Favored Glycine 0 N--CA 1.489 2.188 0 N-CA-C 109.734 -1.347 . . . . 0.0 109.734 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 87.4 p -86.56 -4.36 59.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.32 -1.106 . . . . 0.0 110.355 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -132.05 136.02 46.92 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.369 -0.832 . . . . 0.0 108.972 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.46 158.39 18.37 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -98.07 103.98 15.97 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.121 -0.987 . . . . 0.0 108.691 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.538 ' HG ' ' N ' ' A' ' 77' ' ' GLU . 9.2 t -76.92 150.73 35.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 109.226 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.538 ' N ' ' HG ' ' A' ' 76' ' ' SER . 96.4 mt-10 -148.1 137.65 22.3 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.063 -1.023 . . . . 0.0 108.545 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 38.3 pt -117.86 145.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 CA-C-O 121.582 0.706 . . . . 0.0 109.728 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -159.02 142.22 14.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.291 -0.88 . . . . 0.0 108.63 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.21 137.01 52.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 108.91 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.609 -0.682 . . . . 0.0 110.119 -179.604 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -43.81 152.74 0.32 Allowed 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.804 1.669 . . . . 0.0 112.299 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.9 -40.99 99.26 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.432 -0.793 . . . . 0.0 109.231 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.8 -50.01 75.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -67.68 -30.85 70.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.869 . . . . 0.0 109.69 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 ttt -64.17 -63.97 1.01 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -63.06 -43.13 99.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.142 -0.974 . . . . 0.0 110.071 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.29 -45.87 91.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.4 m -61.93 -44.24 97.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.164 -0.96 . . . . 0.0 110.237 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.5 -46.2 60.37 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.999 -1.063 . . . . 0.0 110.857 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.48 -46.09 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.101 -0.999 . . . . 0.0 109.921 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -67.79 -36.17 79.95 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.362 -0.836 . . . . 0.0 109.671 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.56 93.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.125 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 m -99.55 -0.52 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.305 -0.872 . . . . 0.0 109.952 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.33 -47.17 86.43 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.031 -1.043 . . . . 0.0 108.613 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.441 ' C ' ' H ' ' A' ' 24' ' ' SER . 36.9 mtt180 48.57 34.81 5.28 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.761 0.791 . . . . 0.0 109.987 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 53.48 10.06 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.844 -0.535 . . . . 0.0 109.94 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 22' ' ' ARG . 85.9 p -79.36 165.77 22.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.27 -0.894 . . . . 0.0 109.602 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -56.52 110.33 2.02 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 38.3 m95 46.33 -163.56 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.569 -0.959 . . . . 0.0 110.424 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.82 133.79 40.16 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.53 -0.731 . . . . 0.0 109.179 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -69.15 133.86 48.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.914 . . . . 0.0 109.647 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 36.0 tp -58.38 -39.75 80.46 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.235 -0.916 . . . . 0.0 109.045 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -56.78 -41.3 77.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.254 -0.904 . . . . 0.0 109.257 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.68 88.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.264 -0.898 . . . . 0.0 109.576 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.3 -48.23 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.276 -0.89 . . . . 0.0 109.57 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.71 -46.85 93.37 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.3 m -62.76 -43.26 99.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.19 -1.183 . . . . 0.0 109.877 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE1' ' OD1' ' A' ' 39' ' ' ASN . 58.5 t80 -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 109.655 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.0 mt -63.03 -41.1 99.44 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.294 -0.879 . . . . 0.0 109.168 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.43 -42.67 74.51 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.103 -0.998 . . . . 0.0 109.246 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.93 -42.86 94.31 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.337 -0.852 . . . . 0.0 109.386 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.455 ' OD1' ' CE1' ' A' ' 35' ' ' TYR . 8.2 m120 -88.9 6.5 38.95 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.325 -0.859 . . . . 0.0 109.492 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 36' ' ' LEU . 39.6 t0 -144.94 79.44 11.98 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.36 -0.837 . . . . 0.0 108.8 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -60.57 156.32 42.77 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.197 1.931 . . . . 0.0 111.865 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 p 70.43 -2.98 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.509 -0.744 . . . . 0.0 109.384 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -83.0 134.72 35.04 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.102 -0.999 . . . . 0.0 109.201 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.97 88.32 44.57 Favored Pre-proline 0 N--CA 1.502 2.129 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -54.24 -35.16 82.28 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 121.856 1.704 . . . . 0.0 110.633 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 47.7 mmm-85 -60.19 -36.93 78.74 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.071 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.432 ' C ' ' H ' ' A' ' 49' ' ' GLY . 6.4 m120 -63.3 -37.16 86.16 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.114 -0.991 . . . . 0.0 108.697 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -76.89 19.17 0.3 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.568 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 88.11 156.19 30.24 Favored Glycine 0 N--CA 1.501 2.97 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.473 ' C ' ' H ' ' A' ' 52' ' ' ARG . 58.6 t-80 -78.48 111.64 14.72 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.316 -1.108 . . . . 0.0 109.703 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.451 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 57.35 6.1 2.02 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.473 ' H ' ' C ' ' A' ' 50' ' ' HIS . 40.2 ttp180 -65.46 -1.02 2.2 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.288 -1.125 . . . . 0.0 109.145 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.451 ' H ' ' C ' ' A' ' 51' ' ' GLY . 10.3 mp -62.66 -38.67 91.22 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.7 p -55.24 -33.08 62.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -80.1 -35.96 36.1 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.049 -1.032 . . . . 0.0 109.379 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 tpt -65.42 -45.63 83.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.067 -1.02 . . . . 0.0 109.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.38 -23.86 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.066 -1.021 . . . . 0.0 109.662 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -67.43 -21.69 65.55 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.525 -0.734 . . . . 0.0 109.856 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -91.75 -8.22 47.46 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.072 -1.018 . . . . 0.0 110.543 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mt -94.19 -7.21 42.86 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.986 -1.071 . . . . 0.0 108.197 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 46.86 55.15 8.21 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.742 -0.598 . . . . 0.0 110.931 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -151.51 9.28 0.54 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.892 -1.13 . . . . 0.0 110.575 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mt -137.84 149.03 45.97 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 71.7 m -86.72 122.92 31.3 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.4 t -111.51 118.72 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -144.25 142.63 30.59 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -94.43 152.43 18.61 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.35 -0.844 . . . . 0.0 109.394 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 131.11 21.64 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -73.35 130.49 40.28 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -152.46 155.04 36.72 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 109.618 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.15 -131.18 51.92 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.1 m -113.76 8.68 17.51 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.843 -0.798 . . . . 0.0 109.588 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -147.57 153.56 39.59 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.995 . . . . 0.0 110.061 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.6 tp -63.43 136.95 57.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.486 -0.759 . . . . 0.0 109.237 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -121.88 134.55 54.87 Favored 'General case' 0 N--CA 1.505 2.299 0 CA-C-O 121.644 0.735 . . . . 0.0 109.231 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.4 p -77.86 158.01 29.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.523 -0.736 . . . . 0.0 109.28 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -144.9 144.59 31.17 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 pt -133.07 151.51 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.723 -0.611 . . . . 0.0 109.448 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -155.32 150.54 26.94 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.01 131.64 48.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.896 . . . . 0.0 108.609 -179.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.02 -1.05 . . . . 0.0 109.941 179.941 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -54.68 146.41 54.72 Favored 'Trans proline' 0 N--CA 1.499 1.811 0 C-N-CA 121.731 1.62 . . . . 0.0 112.135 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.23 -41.89 98.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.281 -0.887 . . . . 0.0 108.979 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -59.57 -39.84 85.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 0.0 109.088 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.17 -37.14 86.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.12 -0.988 . . . . 0.0 108.698 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 93.5 mtp -61.22 -48.01 83.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 109.841 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -68.97 -42.02 77.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.228 -0.92 . . . . 0.0 109.913 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 m -62.55 -50.11 72.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.015 -1.053 . . . . 0.0 110.009 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -66.37 -42.62 87.73 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.326 -0.859 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.1 65.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.154 -0.966 . . . . 0.0 111.526 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.88 -44.61 99.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.838 -1.164 . . . . 0.0 109.584 -178.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -66.37 -30.21 70.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.159 -0.963 . . . . 0.0 109.481 -179.897 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -48.48 75.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.132 -0.98 . . . . 0.0 110.721 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.46 18.01 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 121.352 -0.843 . . . . 0.0 109.841 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.58 84.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 109.441 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 22' ' ' ARG . 32.6 mtm180 51.0 72.06 0.39 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 110.773 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 51.78 36.8 18.75 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.429 -0.794 . . . . 0.0 110.203 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.474 ' C ' ' H ' ' A' ' 26' ' ' TRP . 46.5 m -162.51 121.26 2.2 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.077 -1.014 . . . . 0.0 108.836 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.37 0.68 3.56 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.474 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.3 m95 -99.7 145.93 27.08 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.505 -0.997 . . . . 0.0 108.95 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.01 143.85 31.39 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.403 ' N ' ' CD ' ' A' ' 28' ' ' GLU . 35.3 mp0 -68.72 132.39 46.75 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.003 -1.061 . . . . 0.0 109.369 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -55.09 -40.62 70.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.117 -0.989 . . . . 0.0 109.287 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -58.51 -43.76 89.24 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.249 -0.907 . . . . 0.0 108.909 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.03 -37.62 88.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.347 -0.845 . . . . 0.0 109.799 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.0 t -62.05 -49.5 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.11 -43.92 98.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.994 -1.243 . . . . 0.0 109.994 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.1 t -62.69 -45.18 93.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.001 -1.293 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 86.8 t80 -60.96 -48.48 81.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 109.499 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.71 -39.29 93.4 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.426 -0.796 . . . . 0.0 109.112 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.51 82.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.314 -0.866 . . . . 0.0 109.03 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.51 -44.15 91.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.639 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.8 m-80 -64.58 -40.33 95.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.279 -0.888 . . . . 0.0 110.371 -179.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.84 153.21 42.1 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.194 -0.941 . . . . 0.0 109.422 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -47.69 -43.72 27.87 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.19 1.26 . . . . 0.0 111.73 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.2 m -168.97 77.71 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.495 ' CG ' ' N ' ' A' ' 44' ' ' ASP . 45.6 t80 -60.03 -176.19 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.172 -0.955 . . . . 0.0 109.582 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.508 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 3.6 m-20 -145.72 87.97 6.67 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -80.71 -92.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 121.646 1.564 . . . . 0.0 111.245 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.479 ' C ' ' H ' ' A' ' 48' ' ' TRP . 10.3 ptm180 -66.9 -22.3 65.97 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.005 -1.059 . . . . 0.0 109.898 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -51.14 -10.34 0.08 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.072 -1.017 . . . . 0.0 109.795 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.508 ' CD1' ' O ' ' A' ' 44' ' ' ASP . 10.1 m0 -76.59 -25.96 54.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.188 -0.945 . . . . 0.0 108.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 168.06 -168.17 40.62 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -74.45 76.79 1.92 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.391 -1.064 . . . . 0.0 109.787 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.03 17.98 79.18 Favored Glycine 0 N--CA 1.498 2.831 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.453 HH11 ' HG2' ' A' ' 52' ' ' ARG . 75.8 ttt-85 -62.51 -19.03 63.19 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.267 -1.137 . . . . 0.0 108.935 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.32 -44.14 97.18 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -63.03 -35.03 78.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.543 -0.723 . . . . 0.0 109.213 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -77.5 -29.19 52.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.31 -0.868 . . . . 0.0 109.5 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.3 ttp -62.9 -46.4 88.02 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.284 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.67 -30.07 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.196 -0.94 . . . . 0.0 109.554 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.3 -35.95 78.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.187 -0.946 . . . . 0.0 109.8 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -64.34 -35.43 80.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 108.874 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -75.48 138.87 41.88 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.672 -0.642 . . . . 0.0 109.281 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.411 ' C ' ' H ' ' A' ' 63' ' ' LEU . 43.8 m-20 -87.57 -32.72 19.2 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.408 -0.808 . . . . 0.0 111.324 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -76.29 18.0 0.33 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.911 -1.118 . . . . 0.0 110.764 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.4 mt -134.35 127.82 32.44 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.465 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 86.0 m -92.08 135.39 34.01 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.2 t -109.88 130.94 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.483 -0.76 . . . . 0.0 109.146 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -153.4 157.12 39.48 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.0 pm0 -145.86 155.81 43.13 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.051 -1.031 . . . . 0.0 108.558 -179.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 66.1 m -132.4 147.62 52.39 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.626 ' HG3' HH11 ' A' ' 69' ' ' ARG . 9.0 mtm-85 -76.52 140.91 41.34 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.394 0.616 . . . . 0.0 109.79 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -150.94 100.71 2.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.442 -0.786 . . . . 0.0 109.684 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 64.61 -139.09 40.89 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.3 p -89.29 4.62 48.21 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.398 -1.06 . . . . 0.0 109.868 -179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -139.38 114.64 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.468 -0.77 . . . . 0.0 109.542 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -76.06 141.29 42.09 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -102.92 123.07 45.85 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.545 -0.722 . . . . 0.0 109.434 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.8 m -71.18 149.8 45.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.472 -0.768 . . . . 0.0 109.057 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -139.64 153.42 47.31 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 pt -141.39 156.45 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt-85 -137.84 147.96 45.0 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.26 117.9 29.35 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.465 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 92.6 mtt-85 . . . . . 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 110.184 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.539 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.048 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 22.1 Cg_exo -62.45 143.39 93.24 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 122.144 1.896 . . . . 0.0 112.145 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -65.26 -42.02 93.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.383 -0.823 . . . . 0.0 109.233 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.28 -43.75 97.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 109.607 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.26 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 39.8 tpp -61.58 -53.84 51.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.294 -0.879 . . . . 0.0 109.814 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -70.16 -40.66 74.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.193 -0.942 . . . . 0.0 109.999 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -62.63 -45.55 92.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.068 -1.02 . . . . 0.0 109.661 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.522 ' HG ' ' N ' ' A' ' 16' ' ' ALA . 78.2 p -60.17 -45.03 94.46 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.202 -0.936 . . . . 0.0 110.07 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.522 ' N ' ' HG ' ' A' ' 15' ' ' SER . . . -72.46 -48.06 43.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.232 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.57 -44.61 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.126 -0.983 . . . . 0.0 109.475 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -66.27 -33.51 75.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.209 -0.932 . . . . 0.0 109.889 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.38 -59.15 3.63 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.182 -0.949 . . . . 0.0 110.706 -179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -96.72 29.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.345 -0.847 . . . . 0.0 109.918 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.75 -20.49 2.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.974 -1.079 . . . . 0.0 109.97 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' CG ' HH11 ' A' ' 22' ' ' ARG . 3.7 ttt85 60.21 43.4 13.98 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.594 -0.691 . . . . 0.0 109.24 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 41.58 37.49 0.72 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.782 -0.574 . . . . 0.0 111.192 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.434 ' C ' ' H ' ' A' ' 26' ' ' TRP . 74.6 p -143.82 9.32 1.53 Allowed 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.173 -0.954 . . . . 0.0 109.39 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.87 -43.73 0.98 Allowed Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.437 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 99.4 m95 -75.17 174.87 8.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.3 -1.117 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.35 145.43 22.75 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -71.28 127.44 32.56 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.468 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.03 -42.21 68.89 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.125 -0.984 . . . . 0.0 109.512 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -60.13 -43.29 95.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.227 -0.921 . . . . 0.0 109.069 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.02 81.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.75 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.79 -49.04 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.965 -1.084 . . . . 0.0 109.6 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.66 -49.56 77.3 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.3 m -64.98 -42.22 94.74 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.288 -1.125 . . . . 0.0 110.017 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.449 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 63.5 t80 -60.56 -49.3 78.08 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.258 -0.901 . . . . 0.0 109.558 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.486 ' O ' ' N ' ' A' ' 40' ' ' ASP . 91.6 mt -63.1 -41.95 99.48 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.299 -0.876 . . . . 0.0 109.029 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.62 86.88 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.885 . . . . 0.0 109.288 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.5 -42.89 95.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.435 -0.79 . . . . 0.0 109.678 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.449 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.3 m-80 -85.14 -2.93 58.58 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.226 -0.921 . . . . 0.0 109.531 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 36' ' ' LEU . 23.9 t70 -161.14 75.79 2.5 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.83 -27.34 52.53 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.141 1.894 . . . . 0.0 111.071 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 m -66.37 -8.21 24.08 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.566 -0.709 . . . . 0.0 109.397 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -69.31 134.23 48.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.352 -0.842 . . . . 0.0 109.254 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -117.85 91.04 38.16 Favored Pre-proline 0 N--CA 1.504 2.239 0 O-C-N 121.815 -0.553 . . . . 0.0 109.85 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.04 -17.34 30.85 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.148 1.899 . . . . 0.0 111.021 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -63.98 -35.63 81.32 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.613 0.72 . . . . 0.0 109.229 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -61.36 -36.1 79.26 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CD1' ' N ' ' A' ' 48' ' ' TRP . 48.4 m95 -77.99 3.59 14.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 50' ' ' HIS . . . 70.36 -1.71 18.58 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' ARG . 72.9 t60 59.1 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.822 -0.81 . . . . 0.0 109.923 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.532 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 68.91 -65.24 0.48 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.494 HH11 ' HG3' ' A' ' 52' ' ' ARG . 85.2 mtm-85 -59.58 2.45 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.68 -0.894 . . . . 0.0 109.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.532 ' H ' ' C ' ' A' ' 51' ' ' GLY . 59.1 tp -57.77 -41.04 81.18 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.984 -1.073 . . . . 0.0 108.511 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -60.93 -41.97 97.25 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 108.946 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.9 mm-40 -71.52 -30.22 65.68 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.874 -1.141 . . . . 0.0 109.796 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.9 mmm -63.17 -42.99 99.49 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.873 -1.142 . . . . 0.0 109.544 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.0 m -73.55 -22.92 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.089 -1.007 . . . . 0.0 109.734 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -61.92 -39.08 90.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.046 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -98.2 56.77 1.21 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.371 -0.83 . . . . 0.0 110.003 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 mt -146.14 -6.32 0.57 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.508 ' O ' ' N ' ' A' ' 63' ' ' LEU . 23.0 t70 62.68 -174.15 0.15 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.344 -0.847 . . . . 0.0 110.134 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.488 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 31.1 p90 40.72 20.05 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.592 0 CA-C-O 121.295 0.569 . . . . 0.0 110.904 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.3 mt -141.97 131.63 24.07 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.214 -0.929 . . . . 0.0 109.472 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 81' ' ' ARG . 98.5 m -101.37 134.57 44.25 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.78 131.95 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 O-C-N 121.671 -0.643 . . . . 0.0 109.439 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.437 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 88.8 mt-30 -137.65 149.62 46.73 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -140.21 136.23 33.19 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.0 p -132.88 152.46 51.86 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.486 ' NH1' ' HG2' ' A' ' 69' ' ' ARG . 2.8 mtt-85 -89.11 130.66 35.52 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 75' ' ' HIS . 14.4 p-10 -150.31 114.45 5.11 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.019 -1.051 . . . . 0.0 109.619 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.4 -137.16 34.84 Favored Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.3 p -93.47 -0.95 56.21 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.314 -1.109 . . . . 0.0 110.248 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 68.5 mttm -134.81 139.35 45.03 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.376 -0.828 . . . . 0.0 109.684 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.65 151.08 37.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.232 -0.918 . . . . 0.0 109.077 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.47 ' CG ' ' OE2' ' A' ' 77' ' ' GLU . 19.5 t-160 -100.25 100.9 11.78 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.7 p -83.92 151.91 24.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.432 -0.793 . . . . 0.0 108.901 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.472 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 53.9 mp0 -146.44 153.59 40.63 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 pt -133.16 150.82 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 CA-C-O 121.398 0.618 . . . . 0.0 109.746 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -151.72 154.17 35.79 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 81' ' ' ARG . 60.4 mt -64.03 153.29 37.82 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.579 -0.701 . . . . 0.0 109.401 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 80' ' ' LEU . 9.0 tpp180 . . . . . 0 N--CA 1.509 2.512 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m80 . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -46.06 139.03 12.06 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.713 1.608 . . . . 0.0 112.221 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.08 -41.6 99.45 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.326 -0.859 . . . . 0.0 108.798 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -57.96 -38.51 76.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 109.153 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -63.09 -42.13 99.55 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.17 -0.956 . . . . 0.0 109.451 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.5 mmm -63.5 -47.41 81.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.677 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -72.65 -43.86 62.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.094 -1.003 . . . . 0.0 110.163 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.54 -50.14 72.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.122 -0.986 . . . . 0.0 110.331 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.3 m -64.84 -42.33 94.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.37 -0.831 . . . . 0.0 110.254 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.18 48.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.54 -44.29 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 109.861 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -65.43 -33.82 76.84 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.73 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -39.43 93.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.012 . . . . 0.0 110.027 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.29 16.91 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.448 -0.782 . . . . 0.0 110.038 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.1 11.41 9.78 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.966 -1.084 . . . . 0.0 108.774 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -46.71 143.53 2.72 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.382 -0.823 . . . . 0.0 110.7 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 t0 56.05 24.66 8.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.848 -0.533 . . . . 0.0 110.169 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.0 m 51.65 -153.53 0.19 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.976 -1.078 . . . . 0.0 109.921 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.82 56.57 4.07 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.491 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 36.6 m95 42.57 -139.48 0.18 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.779 -0.836 . . . . 0.0 110.624 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.71 138.52 11.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.022 -1.048 . . . . 0.0 108.692 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.87 125.37 28.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.127 -0.983 . . . . 0.0 109.286 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.29 -39.27 66.79 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.346 -0.846 . . . . 0.0 109.104 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.1 t -59.94 -43.94 94.68 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.777 -1.202 . . . . 0.0 108.885 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.29 -40.7 94.17 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.0 t -63.47 -51.0 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.132 -0.98 . . . . 0.0 109.678 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.67 -41.85 99.77 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.21 -44.43 96.59 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.15 -1.206 . . . . 0.0 109.694 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.559 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 76.9 t80 -57.45 -43.34 83.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 109.353 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.0 mt -63.29 -38.16 90.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.916 . . . . 0.0 108.93 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.69 -46.69 70.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.009 -1.057 . . . . 0.0 109.708 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -63.37 -40.17 96.52 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.081 -1.012 . . . . 0.0 109.174 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.559 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 80.1 m-20 -90.46 7.2 40.02 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.074 -1.016 . . . . 0.0 109.297 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.2 t0 -164.71 57.83 0.56 Allowed Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 108.884 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.523 ' C ' ' H ' ' A' ' 43' ' ' PHE . 27.7 Cg_endo -60.9 174.09 1.93 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 122.091 1.86 . . . . 0.0 111.947 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 m 66.36 -6.61 0.48 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.523 ' H ' ' C ' ' A' ' 41' ' ' PRO . 47.8 t80 -94.41 -74.44 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.093 -1.004 . . . . 0.0 108.665 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.1 t0 63.91 91.51 0.08 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.432 ' O ' ' N ' ' A' ' 49' ' ' GLY . 51.2 Cg_exo -54.02 -38.32 86.78 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.84 1.694 . . . . 0.0 111.653 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -55.43 -39.11 69.86 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.602 -0.686 . . . . 0.0 109.916 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -49.8 -44.25 49.01 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.924 -1.11 . . . . 0.0 110.454 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.456 ' NE1' ' CZ ' ' A' ' 43' ' ' PHE . 49.0 p-90 -116.22 16.25 15.88 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.521 -0.737 . . . . 0.0 109.222 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -161.38 62.53 0.28 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.521 ' C ' ' H ' ' A' ' 52' ' ' ARG . 49.9 t-80 -69.27 98.9 1.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.515 -0.991 . . . . 0.0 109.1 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.84 -38.92 0.24 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.049 -1.221 . . . . 0.0 110.049 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.521 ' H ' ' C ' ' A' ' 50' ' ' HIS . 83.6 mtm-85 -66.9 -1.62 4.22 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -1.178 . . . . 0.0 109.442 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.32 -42.18 99.16 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.9 p -62.05 -27.48 68.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.24 -0.912 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -81.87 -34.88 29.84 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -62.44 -41.07 98.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.248 -0.908 . . . . 0.0 109.53 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.83 -9.07 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.384 -0.822 . . . . 0.0 109.766 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -58.75 -30.76 67.75 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.158 -0.963 . . . . 0.0 109.698 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.22 -7.63 48.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.068 -1.02 . . . . 0.0 108.984 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.9 mt -93.82 110.63 22.27 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.96 -1.088 . . . . 0.0 108.891 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' A' ' 63' ' ' LEU . 67.1 t0 -65.09 -37.84 88.82 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.345 -0.847 . . . . 0.0 111.133 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -70.98 20.18 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.772 -1.205 . . . . 0.0 111.262 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 61' ' ' ASP . 10.5 mt -138.07 125.64 22.12 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.222 -0.924 . . . . 0.0 108.839 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 84.0 m -87.8 142.44 27.81 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.397 -0.814 . . . . 0.0 108.883 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.6 t -117.17 129.53 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.491 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 49.3 tt0 -155.9 155.93 33.72 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 1.8 pm0 -144.94 146.42 31.97 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.117 -0.989 . . . . 0.0 110.199 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.1 m -167.23 152.39 7.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.311 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.53 170.63 4.08 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.59 167.77 17.8 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 122.198 0.999 . . . . 0.0 111.056 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.69 -150.3 42.47 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.9 p -96.44 6.92 47.75 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.47 -1.018 . . . . 0.0 109.271 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -87.77 150.62 23.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.079 -1.013 . . . . 0.0 109.504 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -123.86 122.9 39.21 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -91.13 137.19 32.56 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.327 -0.858 . . . . 0.0 108.907 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 m -71.21 140.89 50.62 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.811 -1.181 . . . . 0.0 109.13 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -149.87 136.43 19.17 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.271 -0.893 . . . . 0.0 109.144 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 O-C-N 121.339 -0.851 . . . . 0.0 109.8 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -144.32 145.95 32.3 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.17 138.66 43.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.28 -0.887 . . . . 0.0 108.947 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 . . . . . 0 C--N 1.301 -1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.756 -179.355 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.52 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.179 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 16.2 Cg_exo -66.13 140.73 60.62 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.346 2.03 . . . . 0.0 111.928 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 9' ' ' LEU . 9.9 mp -64.79 -43.59 92.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.148 -0.97 . . . . 0.0 109.346 179.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -63.48 -46.86 84.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.124 -0.985 . . . . 0.0 110.056 -179.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.82 -34.87 79.15 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.163 -0.96 . . . . 0.0 109.608 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.7 ttt -60.9 -51.98 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.142 -0.974 . . . . 0.0 109.982 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -69.7 -39.73 76.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.999 -1.063 . . . . 0.0 109.748 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.8 m -60.4 -45.24 94.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.025 -1.047 . . . . 0.0 109.641 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.443 ' HG ' ' N ' ' A' ' 16' ' ' ALA . 78.3 p -61.94 -42.95 99.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.212 -0.93 . . . . 0.0 110.12 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.443 ' N ' ' HG ' ' A' ' 15' ' ' SER . . . -72.85 -46.05 55.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.061 -1.024 . . . . 0.0 110.843 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.49 -46.6 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.046 -1.034 . . . . 0.0 109.723 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -67.83 -34.19 76.24 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 109.843 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.84 92.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.334 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -100.46 5.74 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.317 -0.865 . . . . 0.0 109.702 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -67.14 -7.7 25.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.013 -1.054 . . . . 0.0 108.877 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -61.91 81.38 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.218 -0.926 . . . . 0.0 109.933 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 21' ' ' ALA . 34.7 t70 -173.54 -50.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.0 t -168.87 -30.69 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.772 . . . . 0.0 109.505 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.38 -64.08 0.33 Allowed Glycine 0 N--CA 1.498 2.809 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.546 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 94.2 m95 -54.28 -174.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -1.137 . . . . 0.0 110.166 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.3 136.64 14.03 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.375 -0.828 . . . . 0.0 108.86 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 56.5 mp0 -73.78 132.03 42.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.286 -0.884 . . . . 0.0 109.684 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.24 -40.81 74.73 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.329 -0.857 . . . . 0.0 109.172 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -57.09 -42.92 81.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.036 -1.04 . . . . 0.0 109.111 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.32 90.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 92.9 t -63.13 -48.84 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 109.542 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.73 97.32 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -68.39 -42.01 79.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -1.179 . . . . 0.0 109.892 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 67.7 t80 -61.64 -47.9 83.31 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.152 -0.967 . . . . 0.0 109.57 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.08 -40.82 98.8 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.236 -0.915 . . . . 0.0 108.753 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.34 77.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.104 -0.998 . . . . 0.0 109.512 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -61.63 -46.43 89.85 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.992 -1.068 . . . . 0.0 109.371 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.537 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.7 m-80 -65.15 -39.29 92.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -0.922 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.45 82.99 44.57 Favored Pre-proline 0 N--CA 1.502 2.128 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.27 -29.69 68.45 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.382 2.055 . . . . 0.0 111.1 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 m -67.63 -7.91 30.38 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.544 -0.723 . . . . 0.0 109.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -88.96 123.07 32.96 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.383 -0.823 . . . . 0.0 108.785 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -124.93 82.26 61.29 Favored Pre-proline 0 N--CA 1.502 2.153 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.505 ' O ' ' N ' ' A' ' 49' ' ' GLY . 34.1 Cg_endo -75.59 -33.64 3.89 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 C-N-CA 121.579 1.519 . . . . 0.0 110.947 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.566 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.6 mtt85 -62.85 -43.61 98.34 Favored 'General case' 0 N--CA 1.492 1.656 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -48.22 -31.53 5.93 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -178.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.8 p-90 -133.42 24.81 4.12 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -169.87 55.9 0.2 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -60.32 -47.2 87.03 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.359 -1.083 . . . . 0.0 109.48 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.408 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -134.51 -29.57 0.42 Allowed Glycine 0 N--CA 1.504 3.193 0 N-CA-C 109.112 -1.595 . . . . 0.0 109.112 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -5.1 2.66 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.369 -1.077 . . . . 0.0 109.177 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' A' ' 51' ' ' GLY . 56.4 tp -62.27 -39.47 93.01 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 0.0 108.796 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.4 t -59.22 -39.9 84.15 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.366 -0.834 . . . . 0.0 109.371 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -75.83 -26.85 57.57 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.089 -1.007 . . . . 0.0 109.886 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.4 mmt -64.73 -43.21 94.11 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.775 -1.203 . . . . 0.0 109.633 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -69.99 -22.39 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.236 -0.915 . . . . 0.0 109.62 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -62.69 -30.8 71.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 109.355 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -63.22 -34.25 77.25 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.206 -0.934 . . . . 0.0 109.272 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.97 116.05 14.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.356 -0.84 . . . . 0.0 109.334 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 63' ' ' LEU . 90.0 m-20 -64.57 -40.78 96.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.538 -0.726 . . . . 0.0 111.596 -178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -70.57 19.03 0.05 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.634 -1.291 . . . . 0.0 111.349 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.496 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.9 mt -136.39 122.25 19.97 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.33 -0.856 . . . . 0.0 109.05 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 97.5 m -91.55 137.65 32.2 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.63 128.23 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.617 -0.677 . . . . 0.0 109.835 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.546 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 26.7 mt-30 -145.06 146.42 31.85 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 55.4 mp0 -95.92 148.49 22.57 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -127.82 140.23 52.16 Favored 'General case' 0 N--CA 1.503 2.197 0 CA-C-O 121.677 0.751 . . . . 0.0 109.498 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.558 HH11 ' HG2' ' A' ' 69' ' ' ARG . 3.3 mmt-85 -77.01 131.54 38.51 Favored 'General case' 0 N--CA 1.497 1.897 0 CA-C-O 121.42 0.629 . . . . 0.0 109.796 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -149.01 101.51 3.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.537 -0.727 . . . . 0.0 110.298 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 59.03 -142.62 46.35 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.8 t -85.68 1.46 49.28 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -1.202 . . . . 0.0 110.15 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -139.04 117.11 11.73 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.359 -0.838 . . . . 0.0 109.564 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.97 174.1 9.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.508 -0.745 . . . . 0.0 109.033 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -144.24 137.67 27.47 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.206 -0.934 . . . . 0.0 109.574 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.2 t -70.22 150.41 46.46 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.488 -0.757 . . . . 0.0 109.402 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -134.94 150.81 50.44 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 pt -132.72 152.61 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -149.96 152.49 35.04 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.04 109.26 14.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.161 -0.962 . . . . 0.0 109.043 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.47 -0.769 . . . . 0.0 110.016 -179.584 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.565 ' H ' ' CD2' ' A' ' 7' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.001 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 144.62 98.91 Favored 'Trans proline' 0 N--CA 1.499 1.845 0 C-N-CA 121.854 1.703 . . . . 0.0 111.882 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.6 mt -63.99 -42.13 97.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.432 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -64.79 -45.91 84.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.882 . . . . 0.0 109.594 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -66.11 -27.16 67.84 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.271 -0.893 . . . . 0.0 109.15 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.7 tpt -67.5 -63.73 1.0 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.474 -0.766 . . . . 0.0 110.309 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -61.89 -45.81 92.11 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.213 -0.929 . . . . 0.0 110.542 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.426 ' HG1' ' N ' ' A' ' 15' ' ' SER . 61.3 p -59.81 -44.06 94.19 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.995 -1.066 . . . . 0.0 110.408 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.426 ' N ' ' HG1' ' A' ' 14' ' ' THR . 11.6 t -61.11 -46.07 92.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.914 -1.117 . . . . 0.0 110.145 -179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.97 -48.39 45.31 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.386 -0.822 . . . . 0.0 110.837 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.57 -48.07 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.132 -0.98 . . . . 0.0 109.711 -178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -66.91 -25.12 66.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 109.546 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.94 -32.73 51.68 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.024 -1.048 . . . . 0.0 110.564 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.5 ' C ' ' H ' ' A' ' 22' ' ' ARG . 5.9 m -108.32 -0.41 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.959 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.459 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -71.82 16.08 0.13 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.915 -1.116 . . . . 0.0 109.081 179.317 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.8 mtp180 -48.77 -13.02 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.881 -1.137 . . . . 0.0 110.422 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 21' ' ' ALA . 25.6 p30 -74.22 -5.89 44.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.241 -0.912 . . . . 0.0 109.339 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p 68.8 40.45 1.73 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.475 -0.766 . . . . 0.0 109.194 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.74 -140.37 4.12 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -54.63 -170.33 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.902 . . . . 0.0 110.064 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.28 139.76 20.52 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.221 -0.924 . . . . 0.0 108.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -69.93 128.04 34.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 109.343 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.5 -39.27 83.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.427 -0.795 . . . . 0.0 109.186 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.0 m -55.68 -43.82 76.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.921 -1.112 . . . . 0.0 109.402 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.93 -37.88 89.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.319 -0.863 . . . . 0.0 109.205 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 75.7 t -62.92 -48.55 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.219 -0.925 . . . . 0.0 109.74 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.19 -44.93 97.03 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 t -62.98 -45.06 94.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.222 -1.164 . . . . 0.0 109.953 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -61.04 -48.77 80.21 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.985 -1.072 . . . . 0.0 109.438 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 40' ' ' ASP . 93.0 mt -65.01 -41.18 95.56 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.216 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.36 -45.69 80.36 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.871 -1.143 . . . . 0.0 109.631 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -64.65 -42.3 95.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -0.884 . . . . 0.0 110.095 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -86.67 -4.56 59.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.08 -1.013 . . . . 0.0 109.689 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 36' ' ' LEU . 16.4 m-20 -154.48 63.76 4.22 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 43' ' ' PHE . 13.6 Cg_endo -54.76 -166.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.739 1.626 . . . . 0.0 111.859 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t 69.36 -6.24 1.0 Allowed 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -178.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' A' ' 41' ' ' PRO . 1.6 t80 -77.51 135.68 38.25 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.234 -0.916 . . . . 0.0 108.661 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -123.82 84.6 54.1 Favored Pre-proline 0 N--CA 1.503 2.218 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -62.56 -25.35 75.55 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 121.905 1.737 . . . . 0.0 110.649 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.451 ' C ' ' H ' ' A' ' 48' ' ' TRP . 47.7 mmm-85 -66.57 -37.74 85.59 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.951 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -55.55 -7.6 0.28 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.444 -0.785 . . . . 0.0 110.052 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.451 ' H ' ' C ' ' A' ' 46' ' ' ARG . 65.3 m95 -97.27 -15.79 20.64 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.136 -0.977 . . . . 0.0 109.613 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 48' ' ' TRP . . . 49.76 101.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.643 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 82.1 t60 51.03 84.4 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.096 -1.237 . . . . 0.0 110.469 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 159.33 -57.36 0.33 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 45.4 mtm180 48.29 -133.19 1.39 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.487 -1.008 . . . . 0.0 110.225 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.405 ' CD1' ' N ' ' A' ' 53' ' ' LEU . 10.3 mp -63.78 -36.57 84.34 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -49.57 -31.2 9.97 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.554 -0.716 . . . . 0.0 109.377 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -82.69 -40.66 20.33 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 33.6 tpp -62.4 -46.99 86.09 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.191 -0.943 . . . . 0.0 109.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.6 m -64.64 -35.37 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.082 -1.011 . . . . 0.0 109.615 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -57.45 -42.64 82.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 -179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -67.24 -44.37 79.62 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.025 -1.047 . . . . 0.0 109.262 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.3 mt -75.56 143.26 42.51 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.444 -0.785 . . . . 0.0 109.94 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 63' ' ' LEU . 71.4 m-20 -92.85 -150.86 0.28 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.335 -0.853 . . . . 0.0 109.913 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 54.4 p90 42.45 19.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.527 -0.733 . . . . 0.0 111.17 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 61' ' ' ASP . 15.7 mt -132.52 130.07 39.93 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.567 -0.708 . . . . 0.0 109.543 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 88.7 m -89.38 134.63 33.99 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 53.3 t -120.19 130.55 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.317 0 O-C-N 121.553 -0.717 . . . . 0.0 109.109 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -151.25 118.73 6.04 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -124.25 135.73 53.62 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.661 0.743 . . . . 0.0 109.705 -178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.7 t -100.23 125.23 46.38 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 mtt180 -68.73 135.59 51.52 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.026 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -150.0 103.89 3.24 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.483 -0.761 . . . . 0.0 109.737 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.74 -142.49 43.56 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 33.3 t -84.74 -9.03 58.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.284 -1.127 . . . . 0.0 110.247 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -121.45 116.55 24.95 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -89.7 151.17 21.99 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.955 -1.09 . . . . 0.0 108.519 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -99.77 99.95 10.84 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.364 -0.835 . . . . 0.0 109.066 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.5 t -75.37 146.58 40.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.407 -0.808 . . . . 0.0 109.217 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -142.75 143.64 32.31 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.9 pt -133.63 155.65 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-O 121.48 0.657 . . . . 0.0 109.77 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt85 -150.23 150.73 31.97 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.53 121.62 19.97 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.451 -0.78 . . . . 0.0 110.268 -178.768 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.534 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 1' ' ' MET . 37.9 Cg_endo -62.61 144.37 94.15 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.247 1.965 . . . . 0.0 111.715 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.52 ' O ' ' N ' ' A' ' 5' ' ' GLU . 80.8 m80 -101.68 133.41 46.44 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.605 -0.684 . . . . 0.0 109.24 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.519 ' O ' ' N ' ' A' ' 6' ' ' LYS . 64.4 mttp 54.23 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.885 -0.51 . . . . 0.0 110.218 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 3' ' ' HIS . 39.1 tp10 60.9 -72.44 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.686 -0.634 . . . . 0.0 109.71 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 4' ' ' LYS . 65.2 mttp 54.12 108.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.734 0.778 . . . . 0.0 110.709 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.54 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -66.9 -42.42 42.74 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.28 -0.887 . . . . 0.0 109.986 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 37.9 Cg_exo -60.69 126.68 20.41 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.05 1.834 . . . . 0.0 111.826 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mp -65.32 -42.26 93.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.197 -0.94 . . . . 0.0 109.366 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -55.18 -53.05 60.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.285 -0.884 . . . . 0.0 110.151 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -67.06 -39.44 86.88 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.117 -0.989 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 49.1 ttp -61.09 -50.09 74.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.249 -0.907 . . . . 0.0 110.045 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -67.47 -38.32 84.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.974 -1.079 . . . . 0.0 109.316 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -46.52 89.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.052 -1.03 . . . . 0.0 109.788 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.4 m -62.38 -43.13 99.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 110.399 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.76 -43.1 84.97 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.022 -1.049 . . . . 0.0 110.613 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.95 -44.83 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 109.609 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -67.26 -34.07 76.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.36 -0.837 . . . . 0.0 109.763 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.57 94.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.354 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.88 7.19 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.317 -0.864 . . . . 0.0 110.183 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -7.11 15.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.928 -1.107 . . . . 0.0 109.695 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.645 ' HG2' HH11 ' A' ' 22' ' ' ARG . 12.1 mtp85 -71.2 -19.93 62.33 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.31 -0.869 . . . . 0.0 108.883 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -61.34 -50.96 70.83 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.206 -0.934 . . . . 0.0 109.481 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 26' ' ' TRP . 2.5 m -179.78 77.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.544 -0.722 . . . . 0.0 109.263 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.0 -91.14 0.02 OUTLIER Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' A' ' 24' ' ' SER . 70.2 m95 -54.7 -174.07 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.444 -1.033 . . . . 0.0 109.985 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.04 134.29 29.57 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.661 -0.649 . . . . 0.0 109.343 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.36 134.63 48.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.342 -0.849 . . . . 0.0 109.335 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.56 -40.58 75.41 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 109.405 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 t -59.34 -43.14 92.8 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.108 -0.995 . . . . 0.0 109.161 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.22 88.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.252 -0.905 . . . . 0.0 109.617 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.45 -46.95 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.242 -0.911 . . . . 0.0 109.363 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.15 81.74 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.9 m -62.45 -42.57 99.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.162 -1.199 . . . . 0.0 109.688 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.546 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 67.8 t80 -60.75 -48.6 81.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.857 . . . . 0.0 109.387 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.5 mt -64.16 -39.08 93.26 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 108.984 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.37 -48.56 80.21 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.99 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -73.15 -51.2 18.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.106 -0.996 . . . . 0.0 110.411 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.546 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 68.8 m-80 -65.43 -39.97 92.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.265 -0.897 . . . . 0.0 109.808 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 31.7 m-20 -123.86 84.66 54.21 Favored Pre-proline 0 N--CA 1.502 2.138 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.32 -28.46 62.76 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.997 1.798 . . . . 0.0 111.333 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.1 p -67.54 -11.83 58.93 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.492 -0.755 . . . . 0.0 109.618 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -75.73 122.63 24.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.12 -0.987 . . . . 0.0 109.122 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -119.58 90.12 42.31 Favored Pre-proline 0 N--CA 1.505 2.278 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -63.28 -20.35 70.34 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.811 1.674 . . . . 0.0 110.776 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -62.71 -38.89 92.25 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.31 -37.97 85.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.296 -0.878 . . . . 0.0 108.725 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.526 ' CD2' ' SD ' ' A' ' 56' ' ' MET . 97.4 m95 -83.95 9.78 11.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.241 -0.912 . . . . 0.0 109.336 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 69.17 151.46 0.45 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.44 ' C ' ' H ' ' A' ' 52' ' ' ARG . 86.7 t60 -79.15 147.69 32.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.354 -1.086 . . . . 0.0 109.549 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.13 -40.01 0.7 Allowed Glycine 0 N--CA 1.494 2.513 0 N-CA-C 110.222 -1.151 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.44 ' H ' ' C ' ' A' ' 50' ' ' HIS . 89.4 mtt180 -67.44 -4.89 12.52 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.125 -1.221 . . . . 0.0 108.933 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.66 -40.8 98.2 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -60.53 -42.81 97.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.333 -0.855 . . . . 0.0 109.282 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.406 ' CD ' ' N ' ' A' ' 55' ' ' GLN . 21.8 mp0 -69.15 -27.12 65.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.86 . . . . 0.0 109.565 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.526 ' SD ' ' CD2' ' A' ' 48' ' ' TRP . 46.6 ttp -63.93 -48.73 75.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.932 -1.105 . . . . 0.0 109.481 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.8 m -69.16 -23.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.276 -0.89 . . . . 0.0 109.612 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.8 -28.62 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.485 -0.759 . . . . 0.0 109.378 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -77.49 -4.13 43.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.96 . . . . 0.0 109.567 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.92 109.82 22.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.352 -0.843 . . . . 0.0 108.984 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.498 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.4 m-20 -64.52 -39.37 93.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.495 -0.753 . . . . 0.0 111.192 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -70.29 19.29 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.851 -1.156 . . . . 0.0 111.288 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.7 mt -138.15 126.61 23.33 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.26 -0.9 . . . . 0.0 108.857 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 43.2 m -88.59 130.97 35.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.6 t -115.6 130.67 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 121.574 -0.704 . . . . 0.0 109.356 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.413 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -142.3 153.72 44.12 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.462 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.3 mp0 -107.46 119.11 38.51 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.4 m -85.49 155.86 21.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.216 -0.927 . . . . 0.0 108.511 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.83 83.17 4.75 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.543 ' ND2' ' CE1' ' A' ' 75' ' ' HIS . 52.6 t-20 -94.0 104.92 16.95 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.417 -0.802 . . . . 0.0 109.502 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.17 -142.09 44.92 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.62 -6.39 58.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.405 -1.056 . . . . 0.0 109.745 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -106.07 142.08 36.37 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.528 -0.732 . . . . 0.0 109.685 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.2 mt -91.6 123.39 34.97 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.543 ' CE1' ' ND2' ' A' ' 70' ' ' ASN . 48.2 m170 -101.9 135.63 43.12 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.605 -0.684 . . . . 0.0 109.299 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.1 m -79.24 148.48 32.19 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.412 -0.805 . . . . 0.0 109.133 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.6 mp0 -137.34 155.02 49.9 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.6 pt -134.48 153.6 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.734 -0.603 . . . . 0.0 109.386 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -143.58 148.77 36.4 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.76 120.46 27.21 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -53.84 132.75 42.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.442 -0.786 . . . . 0.0 110.314 -179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -67.66 -39.7 84.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.684 -0.635 . . . . 0.0 109.58 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.41 145.05 56.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.465 -0.772 . . . . 0.0 110.122 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.68 -163.03 8.28 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 10.1 mp -73.81 141.34 46.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.237 -1.155 . . . . 0.0 109.036 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -159.03 114.06 2.49 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 109.25 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -156.06 20.31 0.37 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.33 -0.856 . . . . 0.0 108.887 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -65.74 -40.52 92.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.464 -0.773 . . . . 0.0 109.625 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 51.92 179.65 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.436 -0.79 . . . . 0.0 110.021 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -66.22 -39.57 89.67 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.339 -0.851 . . . . 0.0 109.549 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -54.26 -79.06 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.219 -0.926 . . . . 0.0 110.079 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.553 -179.745 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.438 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 18.2 mmt . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 1' ' ' MET . 44.4 Cg_endo -63.93 147.1 92.07 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.391 2.061 . . . . 0.0 112.027 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.443 ' CG ' ' N ' ' A' ' 4' ' ' LYS . 9.0 p80 -152.17 -48.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.588 -0.695 . . . . 0.0 109.316 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.443 ' N ' ' CG ' ' A' ' 3' ' ' HIS . 22.6 pttp -81.49 151.51 27.77 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.303 -0.873 . . . . 0.0 109.75 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.41 147.76 39.73 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.257 -0.902 . . . . 0.0 109.23 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -77.37 -5.36 49.38 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.111 -0.993 . . . . 0.0 109.496 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -73.43 153.03 89.99 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 109.207 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -45.83 138.8 11.48 Favored 'Trans proline' 0 N--CA 1.495 1.568 0 C-N-CA 121.701 1.601 . . . . 0.0 112.066 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.95 -41.48 97.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.409 -0.807 . . . . 0.0 109.436 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -57.77 -46.02 85.14 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.387 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.1 -39.1 93.32 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.214 -0.929 . . . . 0.0 109.344 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.73 -52.58 62.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 110.011 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.96 -41.6 74.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.936 -1.102 . . . . 0.0 109.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -60.5 -44.91 95.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.477 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 m -62.33 -42.22 99.2 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.71 79.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -63.05 -44.81 99.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.129 -0.982 . . . . 0.0 109.404 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.14 -32.04 72.88 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.391 -0.818 . . . . 0.0 109.721 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.89 94.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.0 110.72 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 m -124.12 28.76 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.687 0 O-C-N 121.43 -0.794 . . . . 0.0 110.55 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.91 -34.13 62.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.844 -1.16 . . . . 0.0 110.086 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 23' ' ' ASP . 35.8 mtm-85 44.95 77.14 0.08 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.241 -0.912 . . . . 0.0 109.741 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 22' ' ' ARG . 83.9 m-20 57.69 150.39 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.946 0.879 . . . . 0.0 111.014 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.8 m 57.98 157.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.503 -0.748 . . . . 0.0 110.229 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.73 0.22 86.6 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.12 144.69 27.38 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.313 -1.11 . . . . 0.0 109.587 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.75 139.12 29.27 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.457 -0.777 . . . . 0.0 108.93 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.07 131.22 45.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.165 -0.959 . . . . 0.0 109.745 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.13 -37.5 74.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.509 -0.744 . . . . 0.0 109.589 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -57.19 -44.01 83.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.149 -0.969 . . . . 0.0 109.203 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.9 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.211 -0.931 . . . . 0.0 109.271 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.69 -48.32 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.285 -0.884 . . . . 0.0 109.355 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.38 86.56 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 m -62.94 -42.29 99.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.163 -1.198 . . . . 0.0 109.529 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.551 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 76.8 t80 -60.7 -47.09 87.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.352 -0.843 . . . . 0.0 109.476 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.4 mt -62.51 -42.09 99.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.086 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.66 -42.61 79.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.061 -1.025 . . . . 0.0 109.495 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.31 -42.19 96.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.15 -0.969 . . . . 0.0 109.561 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.551 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 81.0 m-20 -90.09 5.14 48.04 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.193 -0.942 . . . . 0.0 109.287 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 36' ' ' LEU . 49.2 t0 -162.7 73.13 2.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.34 -15.82 49.4 Favored 'Trans proline' 0 N--CA 1.489 1.262 0 C-N-CA 121.226 1.284 . . . . 0.0 111.006 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.1 m -74.49 -7.87 54.45 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -74.75 136.36 41.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.475 -0.765 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.12 92.67 45.78 Favored Pre-proline 0 N--CA 1.506 2.33 0 O-C-N 121.949 -0.469 . . . . 0.0 110.151 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -64.01 -16.31 54.16 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 122.061 1.841 . . . . 0.0 111.882 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.453 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 5.3 mpt_? -64.49 -39.88 94.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -63.48 -37.49 87.5 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -92.85 22.62 4.71 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.282 -0.886 . . . . 0.0 108.742 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.31 160.53 3.15 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -77.99 -18.5 55.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.345 -1.091 . . . . 0.0 109.57 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -135.83 -19.25 0.73 Allowed Glycine 0 N--CA 1.505 3.244 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -67.88 2.89 1.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.11 -1.229 . . . . 0.0 109.122 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 51' ' ' GLY . 64.4 tp -62.43 -38.35 89.39 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.665 ' HG ' ' HG ' ' A' ' 76' ' ' SER . 38.8 t -58.95 -42.56 90.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.17 -0.956 . . . . 0.0 109.145 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -66.17 -30.37 70.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.534 -0.729 . . . . 0.0 109.775 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.7 75.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.856 -1.152 . . . . 0.0 110.046 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.12 -17.96 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.246 -0.909 . . . . 0.0 109.801 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.67 -29.21 69.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.359 -0.838 . . . . 0.0 109.369 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.03 -32.22 73.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 63.3 mt -71.93 112.8 8.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 109.228 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.3 m-20 -64.4 -40.89 96.68 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.5 -0.75 . . . . 0.0 111.387 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -69.78 20.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.727 -1.233 . . . . 0.0 111.347 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.8 mt -137.82 133.48 34.02 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.222 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.474 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 89.2 m -97.58 135.28 39.63 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -118.11 132.92 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -134.87 117.86 16.33 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -97.65 119.35 36.06 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.548 -0.72 . . . . 0.0 109.191 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.6 m -102.67 122.29 44.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.571 -0.706 . . . . 0.0 109.357 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 133.49 43.77 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.987 -1.07 . . . . 0.0 109.227 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.1 t-20 -149.89 95.68 2.34 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.561 -0.712 . . . . 0.0 109.482 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 62.99 -139.47 44.78 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 t -83.85 -7.33 59.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.403 -1.057 . . . . 0.0 110.387 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -125.59 123.4 38.96 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.504 -0.748 . . . . 0.0 109.293 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -87.06 153.97 21.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.103 -0.998 . . . . 0.0 108.775 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -105.23 99.79 9.4 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.546 -0.721 . . . . 0.0 109.102 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.665 ' HG ' ' HG ' ' A' ' 54' ' ' SER . 16.1 t -74.56 145.85 43.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.608 -0.683 . . . . 0.0 109.343 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -139.91 155.69 47.05 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.1 pt -133.33 151.05 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 CA-C-O 121.252 0.549 . . . . 0.0 109.592 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -151.94 141.48 21.69 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 19.8 mt -74.38 139.01 43.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.283 -0.885 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.474 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 22.4 mmt180 -64.51 -42.15 95.97 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.234 -0.916 . . . . 0.0 109.465 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -90.19 120.61 31.5 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.218 -0.926 . . . . 0.0 109.243 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -169.59 -26.65 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.236 -0.915 . . . . 0.0 109.319 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.53 -153.77 21.73 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.1 mt 51.48 86.72 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.232 -1.158 . . . . 0.0 109.755 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -168.74 -73.02 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.359 -0.838 . . . . 0.0 109.047 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -79.03 132.03 36.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.256 -0.903 . . . . 0.0 109.541 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.61 ' N ' ' HD1' ' A' ' 90' ' ' HIS . 31.1 p-80 -155.05 163.66 39.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 85.9 t60 52.58 12.1 0.23 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.342 -0.849 . . . . 0.0 109.91 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.61 ' HD1' ' N ' ' A' ' 88' ' ' HIS . 65.8 m80 -93.44 74.55 4.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.237 -0.914 . . . . 0.0 109.178 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -66.9 -39.46 87.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.8 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 76.2 t60 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.784 -179.579 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mmm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.56 146.26 97.09 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.484 2.123 . . . . 0.0 112.466 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.73 125.8 1.22 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.398 -0.814 . . . . 0.0 109.094 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.76 114.9 20.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.106 -0.996 . . . . 0.0 109.537 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -69.29 -37.81 78.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.372 -0.83 . . . . 0.0 109.251 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -158.77 -48.59 0.06 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.251 -0.905 . . . . 0.0 108.804 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 57.68 172.3 0.05 OUTLIER Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.373 -0.829 . . . . 0.0 109.44 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.41 143.22 97.95 Favored 'Trans proline' 0 N--CA 1.502 2.022 0 C-N-CA 121.965 1.776 . . . . 0.0 111.921 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' N ' ' CD1' ' A' ' 9' ' ' LEU . 10.0 mp -63.35 -43.94 96.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.144 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -63.76 -47.63 80.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.812 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -63.77 -35.76 81.65 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.363 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 ttt -64.15 -61.0 2.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.396 -0.815 . . . . 0.0 110.032 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -65.21 -39.95 93.47 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.15 -0.969 . . . . 0.0 109.974 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -61.12 -45.3 95.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.001 -1.062 . . . . 0.0 109.882 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.508 ' HG ' ' N ' ' A' ' 16' ' ' ALA . 78.2 p -61.56 -43.56 98.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.023 -1.048 . . . . 0.0 109.981 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.508 ' N ' ' HG ' ' A' ' 15' ' ' SER . . . -73.55 -48.15 35.24 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 110.706 -179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.443 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.0 mt -63.11 -44.63 99.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 0.0 109.542 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -66.5 -35.16 79.57 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.304 -0.872 . . . . 0.0 109.936 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -38.65 91.97 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.0 110.02 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 m -110.41 11.54 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 121.608 -0.683 . . . . 0.0 109.789 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -59.82 -23.49 63.39 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.879 -1.138 . . . . 0.0 108.713 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' A' ' 24' ' ' SER . 37.3 mtt180 51.77 29.04 5.41 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.6 -0.688 . . . . 0.0 109.85 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 55.4 8.42 0.29 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.374 -0.829 . . . . 0.0 110.5 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.404 ' H ' ' C ' ' A' ' 22' ' ' ARG . 94.6 p -87.7 -3.52 58.96 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.812 -1.18 . . . . 0.0 108.804 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.66 -59.03 5.0 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.461 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 99.1 m95 -75.4 177.22 6.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.407 -1.055 . . . . 0.0 109.442 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 137.3 9.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.264 -0.898 . . . . 0.0 108.874 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -69.39 125.71 27.54 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.286 -0.884 . . . . 0.0 109.424 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.4 tp -57.73 -40.0 78.59 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.675 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -57.42 -42.27 82.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.064 -1.022 . . . . 0.0 109.132 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.17 89.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.221 -0.924 . . . . 0.0 109.528 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.63 -48.39 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 109.493 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.04 -42.7 99.88 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.1 p -66.25 -40.79 90.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -1.19 . . . . 0.0 109.967 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -61.61 -44.69 96.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.1 mt -61.41 -41.83 97.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.123 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.49 -39.55 84.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.346 -0.846 . . . . 0.0 109.094 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -61.6 -46.09 91.34 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.277 -0.889 . . . . 0.0 109.481 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -88.57 -4.51 58.57 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.145 -0.972 . . . . 0.0 109.167 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 36' ' ' LEU . 4.4 m-20 -153.56 64.28 4.87 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.0 -18.5 63.93 Favored 'Trans proline' 0 N--CA 1.494 1.506 0 C-N-CA 121.5 1.467 . . . . 0.0 111.034 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.0 m -76.14 -7.01 53.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 108.578 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -75.95 164.62 25.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.533 -0.73 . . . . 0.0 109.3 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -131.13 79.61 70.55 Favored Pre-proline 0 N--CA 1.504 2.261 0 O-C-N 121.611 -0.681 . . . . 0.0 110.116 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.17 -36.33 92.94 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.95 1.767 . . . . 0.0 111.142 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.58 -34.32 77.55 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.298 0.57 . . . . 0.0 110.158 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.467 ' C ' ' H ' ' A' ' 49' ' ' GLY . 44.6 t30 -60.0 -36.59 77.54 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 108.99 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -78.36 24.56 0.26 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.243 -0.911 . . . . 0.0 109.265 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 74.51 161.8 8.48 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.533 ' C ' ' H ' ' A' ' 52' ' ' ARG . 99.5 m-70 -90.7 123.84 34.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.273 -1.134 . . . . 0.0 109.558 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 69.59 -21.63 0.43 Allowed Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.533 ' H ' ' C ' ' A' ' 50' ' ' HIS . 76.2 mtp85 -71.39 -1.88 14.57 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.185 -1.185 . . . . 0.0 109.007 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.9 tp -61.77 -37.71 85.33 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -58.89 -41.97 88.44 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.361 -0.837 . . . . 0.0 109.319 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -65.65 -31.65 72.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.191 -0.943 . . . . 0.0 109.862 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.7 tpt -64.78 -48.6 73.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.87 -1.144 . . . . 0.0 109.962 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.0 m -75.14 -16.27 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.116 -0.99 . . . . 0.0 109.678 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -60.92 -28.13 68.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.424 -0.797 . . . . 0.0 109.688 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -70.37 -3.3 16.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.133 -0.979 . . . . 0.0 109.006 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.0 mt -99.92 124.59 45.41 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.499 -0.75 . . . . 0.0 109.058 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.7 p-10 -73.44 -36.63 65.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.441 -0.787 . . . . 0.0 111.622 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.461 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 51.6 p90 -73.5 18.81 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.684 -1.26 . . . . 0.0 110.907 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.6 mt -136.33 125.03 23.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.318 -0.864 . . . . 0.0 109.165 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.8 m -89.31 141.95 28.09 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.367 -0.833 . . . . 0.0 109.09 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.5 t -116.06 130.35 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.618 0.723 . . . . 0.0 109.396 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.461 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 51.1 tt0 -153.78 150.63 28.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -140.48 127.91 21.32 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.384 -0.823 . . . . 0.0 109.079 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.7 p -81.71 154.45 26.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.889 -1.132 . . . . 0.0 108.724 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.576 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -90.34 132.45 35.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.215 -0.928 . . . . 0.0 108.711 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -150.66 98.82 2.67 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.886 -1.134 . . . . 0.0 109.643 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 55.51 -140.89 39.54 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 62.1 m -86.32 -7.84 58.17 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.26 -1.141 . . . . 0.0 109.655 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -103.14 118.21 36.28 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.339 -0.851 . . . . 0.0 109.491 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.11 134.82 33.47 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -100.87 104.31 15.53 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 m -74.2 148.84 41.26 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.435 -0.791 . . . . 0.0 109.174 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -141.5 152.04 43.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.426 -0.796 . . . . 0.0 108.945 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.3 pt -139.97 152.12 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.659 -0.65 . . . . 0.0 109.437 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -157.04 154.76 30.05 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.93 138.18 58.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.116 -0.99 . . . . 0.0 109.757 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.8 ttp85 -70.65 81.38 0.6 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 109.799 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -161.21 157.53 25.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.423 -0.798 . . . . 0.0 109.267 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 53.12 34.08 16.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.428 -0.795 . . . . 0.0 109.67 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -157.26 91.26 0.12 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.446 ' CD2' ' N ' ' A' ' 85' ' ' LEU . 3.8 mm? -88.11 -1.03 57.76 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.211 -1.17 . . . . 0.0 109.016 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 85' ' ' LEU . 24.8 mp0 53.63 105.93 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.55 0.691 . . . . 0.0 110.23 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -70.81 149.46 46.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.205 -0.934 . . . . 0.0 109.448 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.6 m80 52.24 178.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.465 -0.772 . . . . 0.0 109.996 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -85.53 144.07 28.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.159 -0.963 . . . . 0.0 109.832 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -71.95 142.72 49.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.409 -0.807 . . . . 0.0 109.581 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -72.68 141.27 48.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.249 -0.907 . . . . 0.0 109.836 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.106 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.534 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.0 mpt? . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 26.6 Cg_exo -61.39 144.9 98.55 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.468 2.112 . . . . 0.0 111.953 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' O ' ' N ' ' A' ' 5' ' ' GLU . 88.2 m-70 -159.07 -61.07 0.07 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.341 -0.85 . . . . 0.0 109.342 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt 59.16 -73.1 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.163 0 CA-C-O 121.123 0.487 . . . . 0.0 110.225 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 3' ' ' HIS . 82.4 tt0 -62.5 -91.5 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.034 -1.042 . . . . 0.0 109.914 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 pttt -97.67 126.06 42.79 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.274 -0.891 . . . . 0.0 110.66 -179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.574 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.06 -34.16 0.39 Allowed Pre-proline 0 N--CA 1.5 2.047 0 O-C-N 121.562 -0.711 . . . . 0.0 110.203 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 44.6 Cg_exo -58.41 127.9 26.44 Favored 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 121.095 1.197 . . . . 0.0 112.055 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.53 -40.27 80.81 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.464 -0.773 . . . . 0.0 109.091 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -56.82 -45.63 82.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -0.94 . . . . 0.0 109.307 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -65.0 -36.97 86.13 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.355 -0.841 . . . . 0.0 109.217 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.4 ttp -62.66 -53.74 49.93 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.418 -0.801 . . . . 0.0 110.0 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -70.7 -41.5 71.89 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.917 -1.115 . . . . 0.0 110.123 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.2 m -60.58 -45.89 92.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.883 -1.135 . . . . 0.0 110.119 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -61.41 -45.15 95.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.47 77.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.204 -0.935 . . . . 0.0 111.106 -178.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.1 mt -61.87 -46.96 95.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.114 -0.991 . . . . 0.0 109.451 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.88 -29.23 69.07 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.433 -0.792 . . . . 0.0 109.8 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.22 -42.89 96.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.149 -0.97 . . . . 0.0 110.708 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.472 ' C ' ' H ' ' A' ' 22' ' ' ARG . 12.6 m -111.98 20.45 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.512 -0.742 . . . . 0.0 109.989 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 2.82 1.31 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.825 -1.172 . . . . 0.0 109.321 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.0 mmt180 61.19 -146.34 0.44 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -59.9 -49.99 75.54 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.626 -0.671 . . . . 0.0 110.178 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t 176.76 87.72 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.284 -0.885 . . . . 0.0 108.804 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.59 -171.2 38.59 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.468 -1.348 . . . . 0.0 109.888 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -58.77 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.67 -0.9 . . . . 0.0 109.556 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.69 142.36 30.01 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.462 -0.774 . . . . 0.0 109.166 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.93 132.85 48.09 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.161 -0.962 . . . . 0.0 110.085 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.27 -39.79 80.14 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.206 -0.934 . . . . 0.0 109.275 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.53 ' HG ' ' N ' ' A' ' 31' ' ' ALA . 80.5 p -55.8 -42.4 75.54 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 109.241 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.53 ' N ' ' HG ' ' A' ' 30' ' ' SER . . . -63.62 -37.39 87.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.582 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.29 -48.29 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.096 -1.003 . . . . 0.0 109.901 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.61 -46.74 93.49 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -64.76 -42.89 94.78 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.109 -1.23 . . . . 0.0 110.094 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.536 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 68.3 t80 -61.21 -48.4 81.67 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.232 -0.917 . . . . 0.0 109.736 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 40' ' ' ASP . 90.1 mt -63.12 -41.97 99.44 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.396 -0.815 . . . . 0.0 109.11 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.33 93.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 108.936 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -64.14 -44.77 91.15 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.295 -0.878 . . . . 0.0 109.707 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.536 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.8 m-80 -82.99 -8.24 59.58 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.188 -0.945 . . . . 0.0 109.494 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.48 ' N ' ' O ' ' A' ' 36' ' ' LEU . 5.1 m-20 -153.76 77.22 5.83 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.37 -30.29 62.46 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.804 1.669 . . . . 0.0 111.115 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 83.6 p -69.01 -12.47 61.72 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.617 -0.677 . . . . 0.0 109.678 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -76.84 122.85 25.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.975 . . . . 0.0 108.399 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -115.41 96.77 46.82 Favored Pre-proline 0 N--CA 1.506 2.368 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.7 -7.42 20.12 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 CA-C-N 120.187 1.103 . . . . 0.0 111.254 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -62.79 -41.45 99.28 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -62.76 -37.48 86.77 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.439 -0.788 . . . . 0.0 109.151 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -81.51 26.4 0.47 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.274 -0.891 . . . . 0.0 109.359 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 56.75 98.91 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -48.93 -28.66 3.99 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -1.187 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.518 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -96.18 -55.54 1.27 Allowed Glycine 0 N--CA 1.502 3.072 0 N-CA-C 108.771 -1.731 . . . . 0.0 108.771 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -62.94 2.75 0.28 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.39 -1.065 . . . . 0.0 109.607 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.518 ' H ' ' C ' ' A' ' 51' ' ' GLY . 57.4 tp -60.44 -42.23 95.69 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.2 t -62.91 -25.93 68.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.489 -0.757 . . . . 0.0 109.739 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -85.09 -34.97 22.1 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 120.976 -1.077 . . . . 0.0 110.056 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.69 -43.58 88.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.887 -1.133 . . . . 0.0 109.872 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 m -63.33 -20.65 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.082 -1.011 . . . . 0.0 109.647 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -69.45 -19.78 63.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.357 -0.839 . . . . 0.0 109.537 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -86.6 0.4 54.51 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.204 -0.935 . . . . 0.0 109.616 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' PHE . 90.5 mt -85.44 -5.48 59.29 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.922 -1.111 . . . . 0.0 109.015 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.563 ' C ' ' H ' ' A' ' 63' ' ' LEU . 8.6 m-20 57.85 -65.29 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.526 -0.734 . . . . 0.0 111.958 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 60' ' ' LEU . 52.6 p90 -63.21 19.07 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.63 -1.294 . . . . 0.0 111.999 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' ' 61' ' ' ASP . 8.1 mt -136.21 128.91 30.8 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.061 -1.024 . . . . 0.0 108.875 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 60.8 m -89.26 140.74 29.18 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.8 t -119.18 131.52 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 O-C-N 121.482 -0.761 . . . . 0.0 109.239 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -141.56 151.85 43.56 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.92 120.03 41.13 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -91.57 151.03 20.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.243 -0.911 . . . . 0.0 108.57 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -91.85 114.27 26.76 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -149.99 118.01 6.32 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.267 -0.896 . . . . 0.0 110.161 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 73' ' ' LYS . . . 56.68 -171.11 2.55 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 178.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.2 m -78.41 28.94 0.19 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.412 -1.052 . . . . 0.0 109.61 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.437 ' H ' ' C ' ' A' ' 71' ' ' GLY . 88.7 tttt -144.78 119.56 9.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.301 -0.874 . . . . 0.0 109.076 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 mt -68.12 132.68 47.64 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 m170 -101.31 119.13 38.29 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.557 -0.714 . . . . 0.0 109.229 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.3 t -71.41 149.74 45.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 109.397 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -141.2 148.76 40.47 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -133.64 147.32 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.558 -0.714 . . . . 0.0 109.563 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -157.98 154.02 27.08 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.29 136.85 57.08 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -66.54 -24.95 66.45 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -65.33 -42.89 92.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.219 -0.926 . . . . 0.0 109.697 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -90.19 112.28 23.73 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.265 -0.897 . . . . 0.0 109.627 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.403 ' O ' ' O ' ' A' ' 85' ' ' LEU . . . 158.76 0.53 0.08 OUTLIER Glycine 0 N--CA 1.496 2.684 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.403 ' O ' ' O ' ' A' ' 84' ' ' GLY . 45.2 mt 53.69 100.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.556 -0.967 . . . . 0.0 109.159 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.57 138.88 57.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.842 . . . . 0.0 110.169 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -167.15 117.52 0.87 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 108.932 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -77.55 130.21 36.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.02 -1.05 . . . . 0.0 109.308 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -70.99 134.85 47.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.156 -0.965 . . . . 0.0 109.609 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' A' ' 90' ' ' HIS . 58.3 t-80 -77.78 50.89 0.88 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.2 -0.937 . . . . 0.0 109.598 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.3 m170 51.3 -175.53 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.476 -0.765 . . . . 0.0 110.47 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.382 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.554 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 3.8 ttm . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.554 ' CD ' ' N ' ' A' ' 1' ' ' MET . 24.6 Cg_exo -64.57 6.28 0.35 Allowed 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.24 1.96 . . . . 0.0 111.704 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.5 ' C ' ' H ' ' A' ' 5' ' ' GLU . 97.9 m-70 -67.44 -35.61 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.208 -0.933 . . . . 0.0 109.71 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -70.92 37.99 0.05 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.183 -0.948 . . . . 0.0 110.046 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.5 ' H ' ' C ' ' A' ' 3' ' ' HIS . 79.4 tt0 -77.56 -79.1 0.12 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.024 -1.048 . . . . 0.0 108.509 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 50.58 -110.81 0.48 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.341 -0.849 . . . . 0.0 110.267 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -74.37 153.28 87.99 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.077 -1.014 . . . . 0.0 109.14 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -47.84 135.04 23.02 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.353 1.369 . . . . 0.0 111.969 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.9 -42.69 97.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.171 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -59.97 -47.82 84.22 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.251 -0.906 . . . . 0.0 109.437 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.3 -35.44 80.38 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.724 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.58 -50.83 69.73 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.279 -0.888 . . . . 0.0 110.35 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -69.16 -48.68 61.61 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.859 -1.151 . . . . 0.0 110.312 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.4 p -60.65 -43.84 97.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.975 -1.078 . . . . 0.0 110.257 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m -60.64 -44.32 96.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.11 -0.994 . . . . 0.0 110.176 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.54 -41.96 75.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 110.505 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 21' ' ' ALA . 93.6 mt -63.64 -46.18 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.161 -0.962 . . . . 0.0 109.93 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.66 -33.96 77.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.025 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.64 91.71 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.166 -0.959 . . . . 0.0 109.913 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.1 m -101.74 -2.78 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 O-C-N 121.364 -0.835 . . . . 0.0 109.968 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.529 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -62.12 -23.45 66.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.966 -1.084 . . . . 0.0 108.896 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 61.74 -2.97 0.24 Allowed 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.402 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.529 ' H ' ' C ' ' A' ' 21' ' ' ALA . 8.8 p30 -175.11 -101.41 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.799 -1.188 . . . . 0.0 108.827 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.486 ' H ' ' CG ' ' A' ' 23' ' ' ASP . 29.9 t -162.02 91.96 0.82 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.925 -1.109 . . . . 0.0 108.89 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.09 -149.35 8.23 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.418 ' CH2' ' CD ' ' A' ' 66' ' ' GLN . 99.2 m95 -68.04 -178.44 1.01 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.632 -0.922 . . . . 0.0 110.044 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -159.57 149.92 19.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.372 -0.83 . . . . 0.0 108.912 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 40.6 mp0 -76.98 128.42 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.244 -0.91 . . . . 0.0 109.581 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.85 -39.85 78.69 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.535 ' HG ' ' N ' ' A' ' 31' ' ' ALA . 78.4 p -55.63 -43.0 75.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.067 -1.021 . . . . 0.0 109.612 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.535 ' N ' ' HG ' ' A' ' 30' ' ' SER . . . -64.55 -38.22 90.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.131 -0.98 . . . . 0.0 109.546 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.3 t -62.7 -48.22 89.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.163 -0.961 . . . . 0.0 109.544 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.85 -48.65 85.19 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -63.2 -42.63 99.35 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.179 -1.189 . . . . 0.0 109.505 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.557 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 83.7 t80 -60.12 -45.51 92.75 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.851 . . . . 0.0 109.505 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 40' ' ' ASP . 66.5 mt -61.67 -43.06 99.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.963 . . . . 0.0 109.187 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.46 91.0 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.16 -0.962 . . . . 0.0 109.132 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.9 -44.69 95.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.885 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.557 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.2 m-80 -89.61 2.04 55.21 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.247 -0.908 . . . . 0.0 109.226 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 36' ' ' LEU . 50.0 t0 -162.81 73.8 2.06 Favored Pre-proline 0 N--CA 1.493 1.696 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.03 -14.96 45.51 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.405 1.403 . . . . 0.0 111.306 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 88.2 p -74.95 -8.96 58.01 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -72.94 141.09 47.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.428 -0.795 . . . . 0.0 109.385 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -119.72 92.56 46.53 Favored Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.67 -0.644 . . . . 0.0 109.919 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.09 -19.29 40.38 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.009 1.806 . . . . 0.0 111.525 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -63.72 -36.53 84.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.505 -0.747 . . . . 0.0 109.199 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.02 -36.24 82.91 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.114 -0.991 . . . . 0.0 108.471 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -78.57 7.21 7.11 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.829 . . . . 0.0 109.394 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.92 152.23 0.04 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.499 ' C ' ' H ' ' A' ' 52' ' ' ARG . 59.3 t-80 -78.41 132.15 37.22 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -1.029 . . . . 0.0 109.603 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.57 -32.61 0.85 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.499 ' H ' ' C ' ' A' ' 50' ' ' HIS . 64.5 ttt180 -67.12 -12.01 58.8 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.272 -1.134 . . . . 0.0 108.49 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -61.34 -42.96 99.54 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 108.587 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -62.47 -42.82 99.75 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -69.14 -32.23 71.44 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.953 . . . . 0.0 109.918 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -46.31 88.99 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.095 -1.003 . . . . 0.0 109.783 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.1 -24.74 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.171 -0.955 . . . . 0.0 109.246 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.95 -29.27 69.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.504 -0.747 . . . . 0.0 109.725 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -70.87 -3.04 17.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.951 . . . . 0.0 109.783 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 64.2 mt -102.38 125.01 48.96 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 35.4 p-10 -68.19 -38.7 82.3 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.341 -0.85 . . . . 0.0 111.536 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.414 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 45.2 p90 -76.45 16.0 0.54 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.715 -1.24 . . . . 0.0 110.433 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.53 117.04 16.66 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.324 -0.86 . . . . 0.0 109.053 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.639 ' HG1' HH21 ' A' ' 81' ' ' ARG . 62.7 m -90.4 141.81 28.36 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.213 -0.929 . . . . 0.0 109.711 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.5 t -126.7 133.79 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CD ' ' CH2' ' A' ' 26' ' ' TRP . 86.6 mt-30 -141.05 137.04 32.62 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -102.37 121.18 41.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.52 -0.737 . . . . 0.0 109.122 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.8 m -92.45 141.74 28.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.279 -0.888 . . . . 0.0 108.998 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.567 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -88.11 90.42 8.38 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.269 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.711 HD21 ' HD1' ' A' ' 75' ' ' HIS . 98.3 m-20 -99.61 106.3 18.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.023 . . . . 0.0 109.676 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.33 -138.76 47.48 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.94 -8.4 57.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.273 -1.133 . . . . 0.0 109.802 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.605 ' HZ3' ' CD2' ' A' ' 75' ' ' HIS . 66.3 tttm -113.0 122.77 48.61 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.441 -0.787 . . . . 0.0 109.805 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mp -85.01 131.51 34.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.711 ' HD1' HD21 ' A' ' 70' ' ' ASN . 37.7 m80 -107.7 125.61 51.59 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-O 121.521 0.677 . . . . 0.0 109.41 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 t -70.8 154.64 41.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.547 -0.72 . . . . 0.0 109.635 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -137.84 154.86 49.46 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.9 pt -136.99 151.42 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 CA-C-O 121.444 0.64 . . . . 0.0 109.673 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.1 ttp85 -151.19 144.9 25.04 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.49 113.41 25.37 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.301 -0.874 . . . . 0.0 109.236 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.639 HH21 ' HG1' ' A' ' 64' ' ' THR . 61.6 ttm-85 -75.89 89.73 2.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.938 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -170.93 -5.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 35.8 p30 -80.42 -3.09 48.44 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.391 -0.818 . . . . 0.0 109.72 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -76.09 93.1 0.96 Allowed Glycine 0 N--CA 1.495 2.606 0 N-CA-C 109.008 -1.637 . . . . 0.0 109.008 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.5 mt -83.28 137.8 33.84 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.173 -1.192 . . . . 0.0 109.674 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 49.19 -166.26 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.407 -0.808 . . . . 0.0 110.324 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -136.57 132.29 34.96 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.583 -0.698 . . . . 0.0 109.219 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -154.15 165.83 35.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.404 -0.81 . . . . 0.0 109.309 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 52.2 m170 51.98 78.99 0.11 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.476 -0.765 . . . . 0.0 109.871 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -153.44 10.65 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.488 -0.757 . . . . 0.0 109.054 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -66.08 -42.14 89.78 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.897 . . . . 0.0 109.858 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 59.6 t-80 . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.474 -179.87 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 tpt . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.1 144.97 99.41 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.462 2.108 . . . . 0.0 111.999 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -75.02 -78.66 0.1 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.172 -0.955 . . . . 0.0 109.382 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.639 ' C ' ' H ' ' A' ' 6' ' ' LYS . 68.7 mttm -64.97 -43.62 92.04 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.506 -0.746 . . . . 0.0 110.17 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 62.25 -19.06 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.795 -0.566 . . . . 0.0 110.018 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.639 ' H ' ' C ' ' A' ' 4' ' ' LYS . 37.2 ttpt -65.82 -43.81 87.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.961 -1.087 . . . . 0.0 110.383 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.418 ' ND1' ' O ' ' A' ' 6' ' ' LYS . 25.0 m-70 -157.18 153.94 24.86 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 121.069 -1.019 . . . . 0.0 109.085 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -45.03 138.02 9.26 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 121.573 1.516 . . . . 0.0 112.386 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 mt -63.58 -40.94 98.25 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.491 -0.755 . . . . 0.0 109.167 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.54 -38.39 77.69 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.472 -0.768 . . . . 0.0 108.947 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -61.73 -42.08 98.49 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.315 -0.865 . . . . 0.0 109.351 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 47.9 mmm -63.54 -44.85 93.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.137 -0.977 . . . . 0.0 109.326 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -69.5 -44.31 71.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.182 -0.949 . . . . 0.0 110.094 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.7 m -62.75 -46.23 89.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.058 -1.026 . . . . 0.0 110.206 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -67.71 -39.1 84.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.283 -0.886 . . . . 0.0 110.202 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -75.47 -48.89 20.64 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.048 -1.032 . . . . 0.0 110.897 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.15 -45.0 99.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.047 -1.033 . . . . 0.0 109.347 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.86 -31.76 72.58 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.383 -0.823 . . . . 0.0 109.71 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.52 96.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.986 -1.071 . . . . 0.0 110.303 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.1 m -118.97 23.94 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.477 -0.764 . . . . 0.0 109.613 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.04 -33.49 70.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.905 -1.122 . . . . 0.0 109.372 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 24' ' ' SER . 20.5 mtm180 51.8 97.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.819 . . . . 0.0 110.476 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 51.07 -82.7 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 110.668 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' ARG . 11.6 p -65.14 157.86 27.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.184 -0.948 . . . . 0.0 109.642 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.1 1.85 78.34 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.411 ' CH2' ' OE1' ' A' ' 66' ' ' GLN . 96.5 m95 -85.03 148.8 25.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.074 -1.25 . . . . 0.0 109.26 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.41 145.68 31.23 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.359 -0.838 . . . . 0.0 109.027 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.14 132.35 46.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.897 . . . . 0.0 109.497 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.2 tp -56.73 -39.94 74.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.46 -0.775 . . . . 0.0 109.275 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.6 m -58.57 -44.04 89.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.141 -0.974 . . . . 0.0 109.267 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.38 -36.48 80.37 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 109.593 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.42 -48.24 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.232 -0.917 . . . . 0.0 109.312 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.82 -48.78 78.3 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.2 t -62.17 -45.11 94.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.125 -1.22 . . . . 0.0 109.745 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.466 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 74.7 t80 -60.09 -48.53 81.34 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.295 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.93 -39.56 90.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 109.382 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.53 75.98 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.057 -1.027 . . . . 0.0 109.824 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -62.44 -41.08 98.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.075 -1.016 . . . . 0.0 109.526 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.466 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 5.0 m120 -64.36 -40.28 95.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.221 -0.924 . . . . 0.0 109.353 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.28 152.58 58.36 Favored Pre-proline 0 N--CA 1.497 1.922 0 O-C-N 121.19 -0.944 . . . . 0.0 108.683 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -45.97 -43.91 19.4 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.439 1.426 . . . . 0.0 111.312 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.9 m -145.65 -92.82 0.09 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.556 ' CZ ' ' NZ ' ' A' ' 4' ' ' LYS . 54.6 t80 61.81 144.71 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.912 0.863 . . . . 0.0 108.99 -179.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -158.76 94.35 1.87 Allowed Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 121.536 -0.727 . . . . 0.0 109.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -70.35 -22.77 28.9 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 CA-C-N 119.536 0.87 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -66.05 -51.68 56.0 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.321 -0.862 . . . . 0.0 109.423 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -64.0 -11.23 27.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.238 -0.914 . . . . 0.0 110.341 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.429 ' HE3' ' HE ' ' A' ' 52' ' ' ARG . 2.4 m95 -81.16 3.01 25.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.904 -1.123 . . . . 0.0 108.954 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.47 164.2 12.6 Favored Glycine 0 N--CA 1.51 3.623 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -73.24 129.36 37.88 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.314 -1.109 . . . . 0.0 109.83 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . 83.82 -89.87 1.57 Allowed Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.429 ' HE ' ' HE3' ' A' ' 48' ' ' TRP . 1.2 tmt_? 50.14 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.994 -0.709 . . . . 0.0 110.613 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.561 ' N ' ' O ' ' A' ' 51' ' ' GLY . 41.6 tp -49.37 -35.99 20.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.0 t -66.58 -36.53 82.86 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.295 0.569 . . . . 0.0 109.649 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -86.2 -32.44 21.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.995 -1.066 . . . . 0.0 110.244 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.8 mtp -64.38 -38.95 92.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.009 -1.057 . . . . 0.0 108.825 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.2 -26.78 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 120.757 -1.214 . . . . 0.0 110.069 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.35 -40.43 82.17 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.187 -0.946 . . . . 0.0 110.635 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -75.43 -0.47 20.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.923 -1.11 . . . . 0.0 110.263 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.1 mt -102.65 115.42 30.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.234 -0.917 . . . . 0.0 109.267 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.441 ' C ' ' H ' ' A' ' 63' ' ' LEU . 68.0 t0 -65.87 -42.5 90.3 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.355 -0.841 . . . . 0.0 111.473 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -71.87 15.32 0.15 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.868 -1.145 . . . . 0.0 110.806 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.441 ' H ' ' C ' ' A' ' 61' ' ' ASP . 0.6 OUTLIER -129.23 117.87 21.43 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.391 -0.818 . . . . 0.0 108.954 -179.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 51.0 m -88.2 144.74 26.27 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.302 -0.874 . . . . 0.0 109.29 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 49.1 t -118.69 130.79 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 CA-C-O 121.531 0.681 . . . . 0.0 109.851 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.411 ' OE1' ' CH2' ' A' ' 26' ' ' TRP . 49.8 tt0 -145.13 152.64 40.37 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.492 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 54.7 mp0 -127.73 118.11 23.18 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 p -79.43 153.73 29.47 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.158 -0.964 . . . . 0.0 108.433 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.4 mtt180 -96.24 134.6 39.15 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.678 HD21 ' HD1' ' A' ' 75' ' ' HIS . 75.3 m-80 -150.05 101.82 3.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.291 -0.881 . . . . 0.0 109.623 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.12 -140.73 44.49 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.9 p -86.44 -7.88 58.07 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.283 -1.128 . . . . 0.0 109.828 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -118.67 110.45 17.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.596 -0.69 . . . . 0.0 109.627 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.03 149.09 29.41 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.678 ' HD1' HD21 ' A' ' 70' ' ' ASN . 81.0 m80 -107.46 129.56 54.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.513 -0.742 . . . . 0.0 109.364 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.6 p -70.62 151.57 44.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.451 -0.781 . . . . 0.0 109.395 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -144.36 156.27 44.16 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.0 pt -138.29 155.02 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.479 -0.763 . . . . 0.0 109.852 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -154.21 146.99 24.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.386 -0.821 . . . . 0.0 108.804 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 69.0 mt -69.05 136.3 52.16 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.218 -0.926 . . . . 0.0 108.634 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -78.56 133.08 37.37 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.274 -0.891 . . . . 0.0 109.639 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -166.43 -176.05 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.41 -0.806 . . . . 0.0 108.889 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t0 54.23 13.23 0.58 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.98 105.56 3.2 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.464 ' O ' ' ND1' ' A' ' 87' ' ' HIS . 34.3 mt -86.25 -4.94 59.27 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.171 -1.194 . . . . 0.0 108.862 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 52.39 -95.54 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.513 -0.742 . . . . 0.0 110.037 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.464 ' ND1' ' O ' ' A' ' 85' ' ' LEU . 57.6 m80 51.01 94.79 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.069 -1.019 . . . . 0.0 109.57 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -65.93 134.64 53.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.227 -0.921 . . . . 0.0 109.034 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -64.76 -42.39 95.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.244 -0.91 . . . . 0.0 109.547 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -91.24 105.44 17.79 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.286 -0.884 . . . . 0.0 109.49 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -168.53 -37.48 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 109.315 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.433 -179.894 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.55 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 1' ' ' MET . 31.2 Cg_exo -62.0 145.0 96.9 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.269 1.979 . . . . 0.0 112.363 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -66.96 -37.52 84.42 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.186 -0.946 . . . . 0.0 109.649 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -68.36 138.66 55.57 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.315 -0.866 . . . . 0.0 109.067 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -81.38 -129.34 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.284 -0.885 . . . . 0.0 109.063 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.72 -81.22 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.95 -1.094 . . . . 0.0 109.734 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.94 152.09 58.57 Favored Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.192 -0.943 . . . . 0.0 109.413 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.35 134.94 15.83 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.608 1.539 . . . . 0.0 112.099 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.38 -41.32 96.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.379 -0.826 . . . . 0.0 109.455 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.33 -41.76 72.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.209 -0.932 . . . . 0.0 109.53 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -65.26 -44.51 87.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.15 -0.969 . . . . 0.0 108.635 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 81.3 mtp -62.55 -49.05 76.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.862 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -68.64 -42.89 77.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.001 -1.062 . . . . 0.0 109.829 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -63.2 -48.05 79.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.942 -1.099 . . . . 0.0 109.993 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.0 p -65.93 -40.32 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.09 -1.006 . . . . 0.0 110.223 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.47 -48.66 31.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.094 -1.004 . . . . 0.0 110.74 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.6 mt -62.88 -45.03 99.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 109.495 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -66.37 -32.83 74.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.58 91.61 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.138 -0.977 . . . . 0.0 110.361 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.3 m -117.96 20.15 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.506 -0.746 . . . . 0.0 109.812 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.14 -27.32 66.97 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.056 -1.027 . . . . 0.0 109.662 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 51.21 85.81 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.724 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 25' ' ' GLY . 31.8 t70 52.78 38.8 27.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.07 -1.019 . . . . 0.0 110.499 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 26' ' ' TRP . 4.1 p 62.01 1.24 0.64 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.86 . . . . 0.0 109.688 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.455 ' H ' ' C ' ' A' ' 23' ' ' ASP . . . -68.46 76.08 0.27 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.61 ' H ' ' NH2' ' A' ' 79' ' ' ARG . 88.7 m95 40.7 -165.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.896 -0.767 . . . . 0.0 111.216 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.74 133.03 10.85 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -71.38 125.98 28.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 109.577 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.6 tp -54.66 -40.29 68.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 109.265 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -58.53 -43.6 89.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.173 -0.955 . . . . 0.0 109.092 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.28 93.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 109.541 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.95 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.04 -1.037 . . . . 0.0 109.064 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.98 85.71 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.2 t -61.78 -43.37 98.98 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.159 -1.201 . . . . 0.0 109.729 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 72.2 t80 -59.52 -46.7 88.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.278 -0.889 . . . . 0.0 109.549 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.1 mt -63.24 -40.4 97.33 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.287 -0.883 . . . . 0.0 109.209 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.09 -47.86 65.02 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.94 -1.1 . . . . 0.0 109.58 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -63.89 -41.41 97.71 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 109.298 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.417 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 10.5 m120 -89.02 8.39 29.92 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.047 -1.033 . . . . 0.0 109.253 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.476 ' N ' ' O ' ' A' ' 36' ' ' LEU . 45.0 t0 -153.38 78.44 5.74 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.335 -0.853 . . . . 0.0 109.173 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.415 ' O ' ' CB ' ' A' ' 42' ' ' SER . 21.1 Cg_exo -62.96 156.52 53.89 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.35 2.033 . . . . 0.0 111.54 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 41' ' ' PRO . 0.9 OUTLIER 75.05 2.68 4.02 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.719 -0.613 . . . . 0.0 109.373 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -93.2 -71.26 0.66 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 55.16 89.42 0.11 Allowed Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.656 -0.652 . . . . 0.0 109.518 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 49' ' ' GLY . 50.8 Cg_exo -54.37 -36.68 88.0 Favored 'Trans proline' 0 N--CA 1.499 1.801 0 C-N-CA 122.246 1.964 . . . . 0.0 111.238 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -58.96 -44.7 91.51 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -47.83 -32.71 6.42 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.345 -0.847 . . . . 0.0 109.921 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 25.5 p-90 -134.37 31.89 3.43 Favored 'General case' 0 N--CA 1.504 2.225 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 51' ' ' GLY . . . -61.9 -76.86 0.22 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.468 ' ND1' ' O ' ' A' ' 50' ' ' HIS . 62.7 t-80 55.19 3.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.686 -0.89 . . . . 0.0 110.447 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 49' ' ' GLY . . . 74.35 -18.29 2.2 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.502 HH11 ' HG3' ' A' ' 52' ' ' ARG . 8.9 ptm180 -61.08 -3.92 0.95 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.126 -1.22 . . . . 0.0 109.195 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 51' ' ' GLY . 58.8 tp -62.67 -44.25 96.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.315 -0.866 . . . . 0.0 108.806 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.6 p -65.13 -34.83 79.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.334 -0.854 . . . . 0.0 109.353 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -74.87 -33.53 62.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.024 . . . . 0.0 109.507 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.77 -46.79 86.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.873 -1.142 . . . . 0.0 109.585 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.0 -23.9 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.376 -0.827 . . . . 0.0 109.826 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.16 -32.1 71.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.28 -0.888 . . . . 0.0 109.433 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -70.88 -1.91 13.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.141 -0.974 . . . . 0.0 109.616 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -103.65 122.8 45.77 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.427 -0.795 . . . . 0.0 108.908 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.483 ' C ' ' H ' ' A' ' 63' ' ' LEU . 40.2 p-10 -73.89 -37.5 64.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.414 -0.804 . . . . 0.0 111.582 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.458 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 50.2 p90 -72.19 19.29 0.07 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.653 -1.28 . . . . 0.0 110.976 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.483 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.0 mt -137.62 125.86 23.14 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.442 -0.786 . . . . 0.0 108.974 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.4 m -92.5 133.56 35.81 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.01 130.87 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.33 0 CA-C-O 121.545 0.688 . . . . 0.0 109.513 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -149.7 144.4 26.07 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.21 122.68 47.01 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.457 -0.777 . . . . 0.0 109.139 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.9 m -78.77 149.54 32.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 109.403 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.57 126.24 33.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.609 -0.682 . . . . 0.0 109.294 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.55 ' ND2' ' NE2' ' A' ' 75' ' ' HIS . 51.4 t30 -149.91 89.62 1.62 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.335 -0.853 . . . . 0.0 109.883 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.36 -140.67 46.67 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.0 p -86.5 -7.55 58.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.197 -1.178 . . . . 0.0 109.992 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -102.98 122.8 45.36 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.3 mt -87.15 129.4 34.95 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.55 ' NE2' ' ND2' ' A' ' 70' ' ' ASN . 17.4 m-70 -98.12 116.79 31.07 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.388 -0.82 . . . . 0.0 109.228 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.7 m -71.96 144.37 48.92 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.499 -0.751 . . . . 0.0 109.186 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -143.39 150.99 39.88 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.22 149.58 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.609 -0.682 . . . . 0.0 109.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.61 ' NH2' ' H ' ' A' ' 26' ' ' TRP . 6.9 ptp180 -155.42 156.49 35.43 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.5 137.22 46.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.893 . . . . 0.0 109.26 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -63.51 -42.14 98.49 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.527 -0.733 . . . . 0.0 109.935 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -56.94 -42.27 79.77 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.923 . . . . 0.0 109.804 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -79.61 -5.3 54.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.146 -0.971 . . . . 0.0 109.611 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.2 -3.02 90.74 Favored Glycine 0 N--CA 1.497 2.73 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.59 126.94 31.86 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.01 -1.288 . . . . 0.0 109.388 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -76.37 145.87 39.13 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.436 -0.79 . . . . 0.0 110.121 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 50.18 95.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.283 -0.886 . . . . 0.0 110.325 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.42 133.18 41.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.271 -0.893 . . . . 0.0 109.485 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -78.51 -6.05 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.201 -0.937 . . . . 0.0 109.494 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -60.45 -42.67 96.64 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.196 -0.94 . . . . 0.0 109.65 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.482 ' O ' ' CG ' ' A' ' 92' ' ' HIS . 41.3 p-80 -151.73 15.68 0.67 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.089 -1.007 . . . . 0.0 109.552 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.482 ' CG ' ' O ' ' A' ' 91' ' ' HIS . 33.9 p80 . . . . . 0 N--CA 1.503 2.225 0 CA-C-O 117.956 -1.021 . . . . 0.0 111.006 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.526 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.53 149.53 84.3 Favored 'Trans proline' 0 N--CA 1.499 1.799 0 C-N-CA 122.178 1.918 . . . . 0.0 112.044 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 p80 -150.27 146.4 26.76 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.288 -0.882 . . . . 0.0 109.076 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -82.43 -83.17 0.13 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.193 -0.942 . . . . 0.0 109.796 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -171.3 146.33 2.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.435 -0.79 . . . . 0.0 109.084 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.59 -78.17 0.05 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.475 -0.766 . . . . 0.0 109.8 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -50.2 150.46 4.35 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.26 -0.9 . . . . 0.0 110.261 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -49.52 134.68 32.95 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 121.412 1.408 . . . . 0.0 112.148 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.56 -41.35 96.36 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 108.989 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -56.39 -48.27 77.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 109.81 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.11 -39.2 92.77 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.193 -0.942 . . . . 0.0 109.477 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.5 ttt -62.78 -53.02 60.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -69.94 -41.82 74.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.914 -1.116 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.6 -47.57 83.2 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.078 -1.014 . . . . 0.0 109.855 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.8 m -62.26 -44.27 96.92 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.291 -0.881 . . . . 0.0 110.208 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.52 -48.12 50.8 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.055 -1.028 . . . . 0.0 110.548 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -62.78 -44.1 99.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.026 -1.046 . . . . 0.0 109.461 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.25 -35.33 80.13 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.176 -0.953 . . . . 0.0 110.01 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.43 -57.9 8.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.067 -1.021 . . . . 0.0 110.621 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.4 m -97.06 27.26 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 121.323 -0.861 . . . . 0.0 110.063 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.408 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -55.39 -32.78 62.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.961 -1.087 . . . . 0.0 110.08 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.632 ' CG ' HH11 ' A' ' 22' ' ' ARG . 9.4 mtt85 48.65 -94.93 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.973 -1.079 . . . . 0.0 110.096 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' N ' ' O ' ' A' ' 21' ' ' ALA . 67.8 t0 -62.69 -53.27 56.94 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.273 -0.892 . . . . 0.0 111.189 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 80.9 p -171.39 -160.24 0.17 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.199 -0.938 . . . . 0.0 109.567 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -50.21 -17.78 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -82.43 136.59 34.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.161 -1.2 . . . . 0.0 108.974 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.88 145.34 31.54 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.47 -0.769 . . . . 0.0 109.328 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.02 131.53 48.92 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.27 -0.894 . . . . 0.0 109.551 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 tp -57.2 -39.88 76.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.244 -0.91 . . . . 0.0 109.554 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -57.74 -41.4 81.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.112 -0.993 . . . . 0.0 109.201 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.373 -0.83 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.18 -48.46 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 109.477 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.66 -48.02 84.66 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.91 -43.85 97.69 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.291 -1.123 . . . . 0.0 109.638 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.539 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 87.6 t80 -60.35 -46.36 90.2 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.186 -0.946 . . . . 0.0 109.263 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.53 -38.92 92.99 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.42 -0.8 . . . . 0.0 109.173 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.34 -46.84 76.38 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.536 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -64.47 -44.17 91.87 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.897 . . . . 0.0 109.517 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.539 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.4 m-80 -65.4 -40.14 93.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.864 . . . . 0.0 110.362 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -90.76 167.15 16.97 Favored Pre-proline 0 N--CA 1.505 2.293 0 O-C-N 121.317 -0.865 . . . . 0.0 108.979 -179.265 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.08 -45.06 43.8 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.497 1.465 . . . . 0.0 111.252 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 t -179.03 88.67 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.426 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 36.4 t80 -61.38 174.4 0.73 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.336 -0.852 . . . . 0.0 109.05 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -133.4 76.18 68.43 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.485 -0.759 . . . . 0.0 110.15 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.56 -37.96 94.6 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.194 1.929 . . . . 0.0 111.932 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -60.65 -37.24 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.606 -0.684 . . . . 0.0 109.233 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 49' ' ' GLY . 58.6 t-20 -59.61 -40.02 86.15 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -82.55 31.47 0.41 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.378 -0.826 . . . . 0.0 108.993 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 67.92 169.75 4.98 Favored Glycine 0 N--CA 1.495 2.586 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -68.16 -39.42 82.62 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.462 -1.022 . . . . 0.0 109.652 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.6 8.51 2.57 Favored Glycine 0 N--CA 1.504 3.194 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -68.1 -12.27 60.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.169 -1.195 . . . . 0.0 108.639 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.79 -40.38 94.99 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.431 ' HG ' ' N ' ' A' ' 55' ' ' GLN . 79.1 p -60.79 -36.95 80.28 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.349 -0.844 . . . . 0.0 109.032 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.431 ' N ' ' HG ' ' A' ' 54' ' ' SER . 14.6 mm100 -69.37 -36.81 77.22 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.377 -0.827 . . . . 0.0 110.12 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.1 tpt -61.22 -47.81 84.41 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.897 -1.127 . . . . 0.0 109.871 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.45 -25.46 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.119 -0.988 . . . . 0.0 109.394 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -62.4 -32.55 73.39 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.374 -0.829 . . . . 0.0 109.513 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -64.04 -33.44 75.76 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.411 -0.806 . . . . 0.0 108.874 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.02 142.53 47.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.391 -0.818 . . . . 0.0 109.433 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.469 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.7 p-10 -90.62 -34.62 15.39 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.282 -0.886 . . . . 0.0 111.273 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.405 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 40.4 p90 -73.04 16.27 0.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.678 -1.264 . . . . 0.0 110.396 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.469 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.1 mt -134.06 127.2 31.73 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.1 m -95.16 134.8 37.49 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -118.04 131.27 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 121.608 -0.682 . . . . 0.0 109.468 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -140.24 137.42 34.25 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.461 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 40.3 mp0 -94.57 134.78 36.76 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -0.793 . . . . 0.0 109.291 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.7 m -117.37 129.92 56.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.644 -0.66 . . . . 0.0 109.346 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -75.11 138.44 42.08 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.775 -1.203 . . . . 0.0 109.735 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -151.0 92.05 1.77 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.72 -140.71 48.05 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.8 p -84.43 -6.21 59.36 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.44 -1.035 . . . . 0.0 110.356 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -123.2 97.72 5.55 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.508 -0.745 . . . . 0.0 109.852 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.9 134.52 50.96 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -103.41 128.35 50.56 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.53 -0.731 . . . . 0.0 109.677 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.5 t -71.29 154.35 41.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.633 -0.667 . . . . 0.0 109.601 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -136.56 145.65 45.23 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.3 pt -132.35 157.1 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -143.51 147.54 34.64 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.79 119.24 24.1 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 79.4 ttt-85 -57.32 126.71 28.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.24 -0.912 . . . . 0.0 109.765 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.641 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 79.8 t60 -171.7 -179.32 2.47 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.641 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 95.2 m-20 53.69 32.05 13.92 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.526 -0.734 . . . . 0.0 109.837 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.91 9.08 54.79 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 10.1 mp 53.67 177.86 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.152 -1.205 . . . . 0.0 109.119 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 87' ' ' HIS . 9.2 tm-20 -165.04 117.29 1.19 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.006 -1.058 . . . . 0.0 109.125 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.459 ' ND1' ' N ' ' A' ' 88' ' ' HIS . 63.3 t-80 55.66 165.92 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.489 0.662 . . . . 0.0 109.963 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.501 ' ND1' ' N ' ' A' ' 89' ' ' HIS . 62.3 t-80 -82.63 161.77 22.1 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.151 -0.968 . . . . 0.0 109.197 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.501 ' N ' ' ND1' ' A' ' 88' ' ' HIS . 36.5 p-80 -154.39 157.11 38.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.063 -1.023 . . . . 0.0 109.491 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -80.2 152.93 28.89 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.437 -0.79 . . . . 0.0 109.836 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 51.99 94.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.549 -0.719 . . . . 0.0 110.208 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 92' ' ' HIS . 46.9 p-80 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.614 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.547 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 1' ' ' MET . 34.7 Cg_exo -62.34 144.99 95.93 Favored 'Trans proline' 0 N--CA 1.5 1.863 0 C-N-CA 122.268 1.979 . . . . 0.0 112.293 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.0 p-80 -157.53 123.77 4.83 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -89.12 -10.64 46.53 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.03 -1.044 . . . . 0.0 109.189 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.76 123.38 17.82 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.086 -1.009 . . . . 0.0 108.873 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -134.87 27.56 3.58 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.558 -0.714 . . . . 0.0 109.144 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.55 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -68.18 -42.45 30.51 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.334 -0.854 . . . . 0.0 109.886 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 34.7 Cg_exo -61.52 138.79 78.07 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.217 1.945 . . . . 0.0 111.738 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.436 ' CD2' ' N ' ' A' ' 9' ' ' LEU . 3.6 mm? -64.96 -41.96 95.02 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.184 -0.948 . . . . 0.0 108.991 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -65.22 -45.64 83.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 109.86 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -64.64 -35.84 82.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.66 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.5 ttt -61.71 -61.43 2.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.29 -0.881 . . . . 0.0 109.852 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -66.86 -40.31 87.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.069 -1.019 . . . . 0.0 110.256 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.9 m -61.75 -46.07 91.21 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.774 -1.204 . . . . 0.0 109.883 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.5 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.039 -1.038 . . . . 0.0 109.966 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.72 -46.75 62.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.479 ' O ' ' N ' ' A' ' 21' ' ' ALA . 98.1 mt -62.56 -45.16 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 109.509 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -67.6 -32.51 73.3 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.093 -1.004 . . . . 0.0 109.093 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.08 -25.71 67.92 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.29 -0.882 . . . . 0.0 109.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.1 m -131.89 19.43 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.423 -0.798 . . . . 0.0 110.335 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.86 -24.75 66.16 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.887 -1.133 . . . . 0.0 108.893 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 51.81 178.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.472 -0.768 . . . . 0.0 110.267 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -68.73 -18.67 64.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.617 -0.677 . . . . 0.0 110.038 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.7 m -74.45 -6.11 46.42 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.901 -1.124 . . . . 0.0 109.469 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -52.51 1.97 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.448 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 96.5 m95 -61.73 178.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -1.13 . . . . 0.0 109.274 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.83 133.13 14.5 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -73.49 132.07 42.49 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.248 -0.907 . . . . 0.0 109.354 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 tp -54.76 -38.45 67.21 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.238 -0.914 . . . . 0.0 109.546 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -57.94 -44.9 87.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.908 -1.12 . . . . 0.0 109.34 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.07 -41.01 99.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.122 -0.986 . . . . 0.0 109.414 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 82.5 t -62.36 -48.14 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.33 -49.17 76.78 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.9 m -61.32 -43.01 99.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.133 -1.216 . . . . 0.0 109.813 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.566 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 69.6 t80 -60.79 -47.35 86.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.253 -0.905 . . . . 0.0 109.385 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 40' ' ' ASP . 80.5 mt -63.0 -40.74 98.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.114 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 41' ' ' PRO . . . -57.51 -48.22 79.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.116 -0.99 . . . . 0.0 109.247 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -61.76 -41.24 97.44 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.204 -0.935 . . . . 0.0 109.132 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.566 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.2 m-80 -80.23 -9.81 59.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.277 -0.889 . . . . 0.0 109.269 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.0 t0 -164.57 71.31 1.55 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.266 -0.896 . . . . 0.0 109.457 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.447 ' N ' ' O ' ' A' ' 37' ' ' ALA . 52.4 Cg_exo -57.14 -30.71 88.07 Favored 'Trans proline' 0 N--CA 1.498 1.788 0 C-N-CA 122.595 2.197 . . . . 0.0 111.489 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -57.11 -13.58 3.08 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.606 -0.684 . . . . 0.0 110.183 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -92.22 -55.51 3.4 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 t0 54.44 85.56 0.19 Allowed Pre-proline 0 N--CA 1.498 1.94 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -54.77 -49.15 17.72 Favored 'Trans proline' 0 N--CA 1.499 1.804 0 C-N-CA 122.328 2.019 . . . . 0.0 112.511 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.461 ' HG2' HH11 ' A' ' 46' ' ' ARG . 66.1 mtp85 -53.19 -52.97 57.11 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.446 -0.784 . . . . 0.0 109.36 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -66.57 -35.09 79.36 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 19.7 t90 -79.34 3.39 18.35 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.193 -0.942 . . . . 0.0 109.777 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.8 126.95 1.01 Allowed Glycine 0 N--CA 1.497 2.714 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -65.91 -45.35 82.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.091 -1.241 . . . . 0.0 109.068 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.8 1.91 0.72 Allowed Glycine 0 N--CA 1.5 2.938 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -66.03 -3.29 5.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.236 . . . . 0.0 109.278 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.2 tp -66.25 -41.6 89.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.122 -0.986 . . . . 0.0 108.668 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 t -59.8 -44.17 94.11 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.438 -0.789 . . . . 0.0 109.66 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -68.09 -30.47 69.65 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.221 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -63.36 -46.97 84.09 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.179 -0.95 . . . . 0.0 109.83 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.1 m -71.75 -21.09 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.159 -0.963 . . . . 0.0 109.788 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -59.42 -31.99 69.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.147 -0.971 . . . . 0.0 109.557 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -73.47 -3.23 26.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.093 -1.004 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.7 mt -100.22 110.23 22.48 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.368 -0.833 . . . . 0.0 108.862 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.475 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.7 t0 -66.12 -37.36 85.53 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 111.523 -179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -71.48 20.03 0.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.727 -1.233 . . . . 0.0 110.981 -178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.2 mt -139.34 127.89 23.05 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.223 -0.923 . . . . 0.0 108.954 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.2 m -90.13 133.2 35.02 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.355 -0.84 . . . . 0.0 109.017 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -120.94 130.73 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.675 -0.641 . . . . 0.0 109.45 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.448 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.6 mt-30 -144.73 153.2 41.44 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.461 -0.774 . . . . 0.0 109.077 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -103.79 144.67 31.17 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.418 -0.801 . . . . 0.0 110.265 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 132.14 44.54 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.638 0.732 . . . . 0.0 109.273 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.633 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -70.21 131.59 44.45 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.542 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 39.7 t-20 -148.69 104.72 3.5 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 120.845 -1.159 . . . . 0.0 109.347 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.28 -140.84 45.45 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 32.1 t -85.22 -3.43 58.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.331 -1.099 . . . . 0.0 110.563 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -134.18 120.39 20.01 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.25 -0.906 . . . . 0.0 109.605 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.75 140.05 58.83 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.678 -0.809 . . . . 0.0 108.828 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.542 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.7 m-70 -102.46 124.32 47.8 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.3 p -71.44 156.63 39.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.491 -0.756 . . . . 0.0 109.035 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.45 149.3 39.07 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.9 pt -142.26 153.92 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.53 -0.731 . . . . 0.0 109.685 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -152.32 152.68 32.41 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.875 . . . . 0.0 108.801 178.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.74 135.08 49.33 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -59.29 -46.57 88.2 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.225 -0.922 . . . . 0.0 109.825 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.633 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 11.6 t-160 -71.54 -137.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.114 -0.991 . . . . 0.0 109.048 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.633 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 96.4 m-20 50.79 -175.54 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.063 -1.023 . . . . 0.0 109.846 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.34 -159.5 51.56 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 3.4 mm? 50.72 28.68 3.72 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 109.342 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.75 137.14 50.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.423 -0.798 . . . . 0.0 109.681 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -78.19 156.88 29.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.488 -0.758 . . . . 0.0 109.517 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -71.97 143.86 49.08 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.244 -0.91 . . . . 0.0 109.309 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.493 ' H ' ' HD1' ' A' ' 89' ' ' HIS . 31.7 p-80 -69.02 130.43 42.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.184 -0.948 . . . . 0.0 109.783 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -67.68 -36.2 80.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.478 -0.764 . . . . 0.0 109.85 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -50.75 145.54 6.83 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.329 -0.857 . . . . 0.0 110.383 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.467 179.896 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.533 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.7 mpt? . . . . . 0 N--CA 1.492 1.651 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -61.3 146.99 96.74 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.543 2.162 . . . . 0.0 112.327 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -87.94 117.58 26.9 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.258 -0.901 . . . . 0.0 108.913 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -80.12 138.11 36.86 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.101 -0.999 . . . . 0.0 109.502 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -58.87 95.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 109.093 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -80.3 -1.91 42.96 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.325 -0.86 . . . . 0.0 108.957 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -47.63 151.49 1.47 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.162 -0.962 . . . . 0.0 109.715 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -55.46 122.66 12.13 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.855 1.703 . . . . 0.0 112.05 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.06 -39.6 93.49 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.647 -0.658 . . . . 0.0 109.527 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -53.84 -48.37 70.01 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.349 -0.845 . . . . 0.0 109.831 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.01 -40.4 94.87 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.221 -0.924 . . . . 0.0 109.341 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.8 ttm -61.85 -51.53 67.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.099 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -70.29 -40.37 74.31 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -61.82 -48.36 80.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.11 -0.994 . . . . 0.0 109.705 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.3 m -62.57 -42.9 99.84 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.155 -0.966 . . . . 0.0 110.262 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.02 -48.29 58.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.035 -1.041 . . . . 0.0 111.034 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.435 ' O ' ' N ' ' A' ' 21' ' ' ALA . 95.3 mt -63.1 -45.35 98.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.093 -1.004 . . . . 0.0 109.789 -178.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.2 -34.24 77.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.706 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.05 -39.1 93.72 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 110.066 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.604 ' C ' ' H ' ' A' ' 22' ' ' ARG . 14.8 m -114.02 16.25 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 121.614 -0.679 . . . . 0.0 110.321 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -63.0 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.68 -1.263 . . . . 0.0 110.041 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.604 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.0 mtp180 -61.13 -142.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.028 -1.045 . . . . 0.0 109.912 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 54.12 -88.5 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.133 -0.979 . . . . 0.0 109.17 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' ARG . 88.5 p -160.58 72.31 0.46 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.74 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.14 -60.88 1.04 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -53.78 178.63 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.324 -1.104 . . . . 0.0 109.821 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -152.8 129.38 10.75 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.13 127.03 29.99 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.141 -0.974 . . . . 0.0 109.47 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.3 tp -57.45 -39.2 75.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.4 -0.812 . . . . 0.0 109.155 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.7 m -57.11 -42.05 80.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.0 109.262 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.51 91.35 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.143 -0.973 . . . . 0.0 109.322 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.9 -47.95 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.17 -0.956 . . . . 0.0 109.224 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.98 -49.79 69.11 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -62.22 -42.33 99.21 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -1.132 . . . . 0.0 109.611 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.3 t80 -60.75 -46.43 90.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.231 -0.918 . . . . 0.0 109.446 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 mt -63.15 -40.01 96.33 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.122 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 109.275 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.04 -43.13 96.46 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 109.595 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 82.9 m-20 -90.51 4.66 50.49 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.242 -0.911 . . . . 0.0 109.136 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 36' ' ' LEU . 21.8 t70 -168.23 77.24 0.85 Allowed Pre-proline 0 N--CA 1.489 1.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.44 -28.14 52.76 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.137 1.891 . . . . 0.0 111.331 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.1 t -63.32 -15.53 57.63 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.462 -0.773 . . . . 0.0 109.587 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -75.01 131.3 40.53 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.227 -0.921 . . . . 0.0 109.085 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 18.6 p30 -138.45 83.07 21.5 Favored Pre-proline 0 N--CA 1.5 2.059 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -58.7 -24.78 72.66 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 45.2 mmm-85 -67.42 -42.52 83.06 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.846 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -72.77 -12.13 60.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.291 -0.88 . . . . 0.0 109.153 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -81.7 -2.83 51.89 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.21 -0.931 . . . . 0.0 109.581 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.12 13.81 7.48 Favored Glycine 0 N--CA 1.508 3.484 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.413 ' C ' ' H ' ' A' ' 52' ' ' ARG . 17.0 m80 56.24 110.73 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.653 -0.91 . . . . 0.0 110.736 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.75 -6.47 12.35 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.413 ' H ' ' C ' ' A' ' 50' ' ' HIS . 6.5 tpp180 -66.93 -7.75 24.41 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.386 -1.067 . . . . 0.0 109.034 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.35 -42.79 99.68 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -62.44 -43.61 98.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 109.539 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 25.9 mp0 -71.54 -27.9 63.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.312 -0.868 . . . . 0.0 109.395 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 44.7 ttp -67.67 -47.12 70.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.096 -1.002 . . . . 0.0 109.804 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.4 m -72.69 -14.85 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.068 -1.02 . . . . 0.0 109.702 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.32 -26.82 65.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.425 -0.797 . . . . 0.0 109.83 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -80.59 -3.69 51.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.05 -1.031 . . . . 0.0 109.418 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -99.07 110.22 22.84 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.488 ' C ' ' H ' ' A' ' 63' ' ' LEU . 92.2 m-20 -64.58 -39.02 92.99 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.403 -0.811 . . . . 0.0 111.325 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -70.27 21.16 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.718 -1.239 . . . . 0.0 111.199 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.488 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.8 mt -138.21 131.9 31.01 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.192 -0.942 . . . . 0.0 108.978 178.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 86.8 m -93.43 134.83 35.27 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.322 -0.861 . . . . 0.0 108.689 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.6 t -122.62 131.17 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.473 -0.767 . . . . 0.0 109.244 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.0 tt0 -150.68 153.68 36.05 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.6 pm0 -149.92 154.22 37.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.292 -0.88 . . . . 0.0 109.066 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 70' ' ' ASN . 45.1 t -143.85 132.23 22.09 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.452 -0.78 . . . . 0.0 109.35 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.525 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.8 OUTLIER -64.55 84.0 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' SER . 98.2 m-20 -98.6 142.94 29.55 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.382 -0.824 . . . . 0.0 109.544 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.53 -142.78 42.72 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -100.72 9.6 42.23 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.671 -0.899 . . . . 0.0 109.585 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.442 ' O ' ' ND1' ' A' ' 75' ' ' HIS . 36.6 ttmt -138.16 139.1 39.21 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.34 -0.85 . . . . 0.0 109.971 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.3 tp -66.44 128.95 38.18 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.442 ' ND1' ' O ' ' A' ' 73' ' ' LYS . 64.6 m80 -108.24 104.66 14.11 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.7 m -85.31 150.14 24.97 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.483 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -144.79 149.26 35.17 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.367 -0.833 . . . . 0.0 108.951 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.8 pt -135.08 152.25 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.725 -0.609 . . . . 0.0 109.467 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -141.04 155.81 46.12 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.48 94.31 6.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.877 . . . . 0.0 108.886 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 37.01 53.7 1.16 Allowed 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.533 0.682 . . . . 0.0 111.03 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -86.78 66.81 9.62 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.817 -1.177 . . . . 0.0 108.645 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -83.62 114.43 21.54 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.77 146.96 2.25 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.5 mt -64.29 -41.76 96.73 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.275 -1.132 . . . . 0.0 109.166 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -170.71 -74.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.002 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -76.31 171.74 14.05 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.214 -0.929 . . . . 0.0 109.59 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -163.81 120.37 1.7 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.321 -0.862 . . . . 0.0 108.873 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.9 t60 50.41 82.49 0.05 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.286 -0.884 . . . . 0.0 109.896 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -73.45 138.32 45.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.49 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -71.63 141.27 49.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.243 -0.911 . . . . 0.0 109.794 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 50.4 p-80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.604 179.865 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.6 mtt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -60.82 145.41 99.04 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.471 2.114 . . . . 0.0 112.402 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -65.82 -45.5 82.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.305 -0.872 . . . . 0.0 109.713 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -78.92 137.06 37.46 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.248 -0.908 . . . . 0.0 109.834 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -94.09 114.5 26.66 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.373 -0.829 . . . . 0.0 109.093 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.05 31.4 1.44 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.123 -0.986 . . . . 0.0 108.511 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 m170 -54.11 152.34 11.14 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.263 -0.898 . . . . 0.0 109.269 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -44.85 129.87 9.78 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.651 1.567 . . . . 0.0 112.086 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.99 -41.77 95.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.493 -0.755 . . . . 0.0 109.361 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.462 ' NE2' ' OG1' ' A' ' 14' ' ' THR . 19.9 tm0? -56.33 -48.77 76.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.326 -0.859 . . . . 0.0 109.41 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.01 -34.66 78.21 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttt -62.62 -52.56 62.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.301 -0.874 . . . . 0.0 110.328 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.45 -42.01 75.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.908 -1.12 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.462 ' OG1' ' NE2' ' A' ' 10' ' ' GLN . 97.0 m -61.63 -44.45 96.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.845 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.1 t -61.67 -45.02 95.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.087 -1.008 . . . . 0.0 110.218 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.3 -46.11 51.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.261 -0.899 . . . . 0.0 110.897 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.05 -45.55 98.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.165 -0.959 . . . . 0.0 109.902 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.22 -32.81 72.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.245 -0.909 . . . . 0.0 109.834 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.13 -40.25 94.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.255 -0.903 . . . . 0.0 110.391 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.499 ' C ' ' H ' ' A' ' 22' ' ' ARG . 10.6 m -100.05 6.31 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 O-C-N 121.253 -0.905 . . . . 0.0 109.742 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.0 8.5 0.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.032 -1.043 . . . . 0.0 109.461 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.499 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.5 mtp180 -61.83 -40.5 95.51 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.078 -1.014 . . . . 0.0 109.859 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' O ' ' N ' ' A' ' 25' ' ' GLY . 37.0 p-10 -73.89 121.43 20.93 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.076 -1.015 . . . . 0.0 109.549 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' A' ' 25' ' ' GLY . 96.3 p 47.38 -91.78 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.389 -0.82 . . . . 0.0 110.445 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 23' ' ' ASP . . . -159.41 -59.04 0.01 OUTLIER Glycine 0 N--CA 1.494 2.558 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.432 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 81.9 m95 -55.27 -177.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.396 -1.061 . . . . 0.0 109.872 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.08 135.06 32.19 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.636 -0.665 . . . . 0.0 109.239 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -71.31 134.83 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.257 -0.902 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 tp -55.6 -40.86 72.6 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 109.287 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.637 ' HG ' HH22 ' A' ' 46' ' ' ARG . 40.0 t -59.57 -43.8 93.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.112 -0.992 . . . . 0.0 108.991 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.15 86.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.237 -0.914 . . . . 0.0 109.664 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 73.5 t -61.72 -48.86 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.09 -1.006 . . . . 0.0 109.132 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.15 92.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.41 ' HB2' HH21 ' A' ' 46' ' ' ARG . 7.4 t -61.68 -44.28 97.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.859 -1.377 . . . . 0.0 109.832 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.547 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 71.6 t80 -57.98 -43.91 86.83 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.247 -0.908 . . . . 0.0 109.409 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.3 -40.3 96.98 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.337 -0.852 . . . . 0.0 108.992 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.089 -1.007 . . . . 0.0 109.192 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -61.04 -42.52 98.63 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.303 -0.873 . . . . 0.0 109.497 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.547 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.1 m-80 -83.01 -6.07 59.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.275 -0.891 . . . . 0.0 108.714 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -153.69 74.01 6.51 Favored Pre-proline 0 N--CA 1.495 1.799 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.25 -35.31 73.51 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.288 1.992 . . . . 0.0 111.204 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.6 p -66.57 -10.98 50.88 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.539 -0.725 . . . . 0.0 109.415 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -88.36 148.32 24.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.277 -0.889 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -129.45 78.18 76.1 Favored Pre-proline 0 N--CA 1.502 2.145 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 49' ' ' GLY . 41.7 Cg_endo -78.21 -27.3 5.6 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.724 1.616 . . . . 0.0 110.83 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.637 HH22 ' HG ' ' A' ' 30' ' ' SER . 25.2 mmt180 -65.02 -45.25 86.3 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.439 -0.788 . . . . 0.0 109.192 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -48.6 -30.85 5.81 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.319 -0.863 . . . . 0.0 110.295 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 15.0 p-90 -135.62 25.19 3.42 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.252 -0.905 . . . . 0.0 109.829 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -87.43 -11.54 68.81 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -66.5 -40.74 89.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.006 -1.291 . . . . 0.0 109.425 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.646 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . -139.89 -147.94 5.11 Favored Glycine 0 N--CA 1.502 3.073 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 49.0 -74.84 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 CA-C-N 117.53 0.665 . . . . 0.0 110.535 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.646 ' N ' ' O ' ' A' ' 51' ' ' GLY . 64.7 tp -51.18 -41.67 60.36 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.098 -1.001 . . . . 0.0 108.571 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.1 p -63.98 -29.66 70.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.484 -0.76 . . . . 0.0 109.137 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -85.87 -29.3 23.8 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.265 -0.897 . . . . 0.0 109.562 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.7 mtt -63.61 -41.4 98.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.158 -0.964 . . . . 0.0 109.15 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.7 m -61.47 -41.42 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.242 -0.911 . . . . 0.0 108.93 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.65 -31.98 72.36 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.692 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -89.56 -2.38 58.32 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.109 -0.994 . . . . 0.0 110.417 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 62' ' ' PHE . 6.3 mt -88.09 5.4 41.32 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.203 -0.936 . . . . 0.0 109.196 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.6 t0 56.55 -75.77 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.781 -0.574 . . . . 0.0 111.793 178.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 60' ' ' LEU . 47.6 p90 -65.52 26.95 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.623 -1.298 . . . . 0.0 111.848 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 61' ' ' ASP . 1.2 mm? -124.86 126.81 46.15 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 120.948 -1.095 . . . . 0.0 108.351 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.1 m -88.45 141.93 28.13 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.54 131.14 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.503 -0.748 . . . . 0.0 109.371 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.432 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -145.53 155.3 42.99 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 38.8 mp0 -114.58 123.95 50.63 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 89.8 p -109.44 150.92 27.38 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 130.54 34.76 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.589 0.709 . . . . 0.0 109.367 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -152.1 112.81 4.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.414 -0.804 . . . . 0.0 109.263 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.41 -144.64 47.41 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.4 p -92.92 1.92 57.05 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.509 -0.994 . . . . 0.0 109.864 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -123.71 135.94 54.16 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.487 -0.758 . . . . 0.0 109.935 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 73.6 mt -75.41 132.42 40.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -104.89 117.03 33.02 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.569 -0.707 . . . . 0.0 109.114 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.0 t -68.12 139.28 56.17 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.371 -0.83 . . . . 0.0 109.476 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -126.26 143.74 51.04 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.9 pt -135.37 158.44 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.742 -0.599 . . . . 0.0 110.07 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -147.98 139.8 23.94 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.38 106.76 0.57 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -65.95 140.74 58.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 109.957 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -76.69 11.08 1.81 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.36 -0.838 . . . . 0.0 109.313 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.456 ' C ' ' H ' ' A' ' 85' ' ' LEU . 61.9 t0 55.6 35.28 24.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.592 -0.693 . . . . 0.0 109.787 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -75.79 31.85 1.25 Allowed Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.456 ' H ' ' C ' ' A' ' 83' ' ' ASP . 2.3 tt -89.16 115.36 26.62 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.092 -1.24 . . . . 0.0 108.325 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 51.51 96.88 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.244 -0.91 . . . . 0.0 110.086 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -72.43 138.99 47.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 109.565 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -73.91 141.63 46.0 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.315 -0.865 . . . . 0.0 109.17 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 80.6 m80 -73.64 140.97 46.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.142 -0.974 . . . . 0.0 109.644 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.99 137.95 45.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.327 -0.858 . . . . 0.0 110.001 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 48.51 74.86 0.16 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.442 -0.786 . . . . 0.0 110.481 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . 0.447 ' OXT' ' CG ' ' A' ' 92' ' ' HIS . 56.9 t-80 . . . . . 0 N--CA 1.494 1.741 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.01 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.7 mtm . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -61.13 145.84 98.31 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.408 2.072 . . . . 0.0 112.039 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -122.33 145.32 48.37 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -72.14 138.71 47.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.344 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.5 tp10 -102.5 -23.35 13.91 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.6 mtmm -88.67 -6.25 57.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.09 -1.007 . . . . 0.0 109.014 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -171.46 77.08 0.51 Allowed Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 121.531 -0.73 . . . . 0.0 109.046 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.67 143.47 95.01 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.317 2.012 . . . . 0.0 112.192 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -63.8 -41.2 97.96 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.88 -39.6 81.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.259 -0.901 . . . . 0.0 109.255 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -61.82 -43.54 98.65 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.3 -0.875 . . . . 0.0 109.129 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.2 mtt -63.89 -46.76 83.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.208 -0.933 . . . . 0.0 109.868 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -69.74 -44.12 70.91 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.228 -0.92 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.6 m -63.28 -47.2 83.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.937 . . . . 0.0 110.147 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -66.5 -40.27 89.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 110.133 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.059 -1.026 . . . . 0.0 110.603 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -62.71 -44.45 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.349 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.73 -33.54 75.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 110.063 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 -58.92 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.134 -0.979 . . . . 0.0 110.467 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -98.31 29.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.314 -0.866 . . . . 0.0 109.453 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -48.91 -33.6 11.11 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.011 -1.056 . . . . 0.0 109.659 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.695 ' HG2' HH11 ' A' ' 22' ' ' ARG . 40.8 ttp85 51.92 -87.48 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.466 -0.771 . . . . 0.0 110.605 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 21' ' ' ALA . 95.9 m-20 -60.74 -88.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.892 -1.13 . . . . 0.0 109.989 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.424 ' C ' ' H ' ' A' ' 26' ' ' TRP . 31.6 t -167.99 97.95 0.45 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.099 -1.001 . . . . 0.0 109.363 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.5 -25.69 2.38 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.424 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.2 m95 -91.51 142.69 27.38 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.209 -1.171 . . . . 0.0 109.607 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.48 141.7 29.75 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.305 -0.872 . . . . 0.0 108.945 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -67.54 130.36 42.8 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.291 -0.881 . . . . 0.0 109.728 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.72 -39.47 71.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.349 -0.844 . . . . 0.0 109.225 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 t -58.6 -44.0 89.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.098 -1.001 . . . . 0.0 109.173 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.32 87.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.154 -0.966 . . . . 0.0 109.684 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.09 -48.98 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.078 -1.014 . . . . 0.0 109.387 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.47 -44.39 97.73 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.429 ' HG ' ' N ' ' A' ' 35' ' ' TYR . 78.0 p -69.64 -40.33 76.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 109.804 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.513 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 70.7 t80 -61.71 -48.52 80.39 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.249 -0.907 . . . . 0.0 109.637 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.0 mt -63.09 -42.14 99.55 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.232 -0.918 . . . . 0.0 108.954 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.64 87.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.907 . . . . 0.0 109.084 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -64.97 -42.85 94.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 109.383 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.513 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.5 m-80 -84.78 -4.64 59.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.171 -0.955 . . . . 0.0 109.352 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 36' ' ' LEU . 7.9 m-20 -154.74 74.24 5.78 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.278 -0.889 . . . . 0.0 108.884 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.0 -35.18 80.09 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.377 2.051 . . . . 0.0 111.286 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.8 t -65.4 -12.47 52.58 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.47 136.12 56.75 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.301 -0.874 . . . . 0.0 108.784 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.438 ' O ' ' ND2' ' A' ' 47' ' ' ASN . 66.2 m-20 -120.45 92.26 47.41 Favored Pre-proline 0 N--CA 1.502 2.141 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.17 -8.31 21.85 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 121.175 1.25 . . . . 0.0 111.49 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.676 HH11 ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -66.85 -41.9 86.63 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.566 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.556 ' O ' ' NH2' ' A' ' 52' ' ' ARG . 17.1 p30 -70.48 -22.09 62.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.528 -0.733 . . . . 0.0 109.549 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.523 ' CE3' ' SD ' ' A' ' 56' ' ' MET . 89.7 m95 -93.61 3.81 54.93 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.131 -0.981 . . . . 0.0 109.112 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.35 138.74 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -68.22 -36.27 79.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.139 -1.212 . . . . 0.0 110.267 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.62 -34.83 5.87 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.556 ' NH2' ' O ' ' A' ' 47' ' ' ASN . 46.3 ttp180 -63.93 -17.51 63.31 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.547 -0.973 . . . . 0.0 109.247 -178.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.3 tp -62.9 -43.05 99.83 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -64.83 -27.6 68.99 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.499 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -80.86 -34.28 33.86 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.139 -0.976 . . . . 0.0 109.4 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.523 ' SD ' ' CE3' ' A' ' 48' ' ' TRP . 47.3 ttp -61.48 -45.75 92.93 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -60.94 -31.3 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.28 -0.888 . . . . 0.0 109.487 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -64.6 -30.65 71.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.349 -0.844 . . . . 0.0 109.896 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -86.94 -7.04 58.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.998 -1.064 . . . . 0.0 110.164 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.7 mt -101.36 127.08 48.16 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.322 -0.861 . . . . 0.0 109.051 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' CG ' ' A' ' 62' ' ' PHE . 97.3 m-20 -65.24 -168.91 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.244 -0.91 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CG ' ' O ' ' A' ' 61' ' ' ASP . 54.5 p90 42.89 16.51 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 122.028 -0.42 . . . . 0.0 111.427 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -132.83 116.37 16.44 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.247 -0.908 . . . . 0.0 108.792 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.1 m -91.98 141.02 29.08 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.5 t -114.84 130.01 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-O 121.525 0.679 . . . . 0.0 109.621 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -154.23 143.74 21.51 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -108.92 152.25 25.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.646 -0.659 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.5 m -127.38 131.37 50.34 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.566 ' HD3' ' N ' ' A' ' 69' ' ' ARG . 0.1 OUTLIER -77.52 136.63 38.34 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.462 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.413 HD21 ' HD1' ' A' ' 75' ' ' HIS . 87.4 m-20 -149.56 101.2 3.07 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.154 -0.966 . . . . 0.0 109.367 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.73 -141.77 47.81 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.0 p -86.97 -3.97 59.13 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.488 -1.007 . . . . 0.0 109.953 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -115.71 121.81 43.62 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.675 -0.641 . . . . 0.0 110.143 -179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 tt -82.46 130.11 35.04 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.413 ' HD1' HD21 ' A' ' 70' ' ' ASN . 38.0 m80 -110.22 124.55 51.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.517 -0.739 . . . . 0.0 109.694 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.5 m -72.01 151.92 42.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.518 -0.739 . . . . 0.0 109.294 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -138.78 151.74 47.33 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.1 pt -137.17 156.45 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.623 0.725 . . . . 0.0 109.525 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -157.81 151.04 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.1 mt -70.33 139.52 52.03 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -68.67 89.89 0.39 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.221 -0.925 . . . . 0.0 109.935 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.473 ' O ' ' N ' ' A' ' 84' ' ' GLY . 86.5 t60 -157.6 159.07 36.68 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 108.812 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 52.15 -89.17 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.376 -0.828 . . . . 0.0 110.009 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 82' ' ' HIS . . . 79.72 -155.45 39.21 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.68 135.11 36.46 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.272 -1.134 . . . . 0.0 109.168 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -164.63 -32.11 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.202 -0.936 . . . . 0.0 109.061 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -81.1 -10.12 59.71 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.453 -0.78 . . . . 0.0 109.366 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.64 -39.44 84.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.475 -0.765 . . . . 0.0 109.398 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -54.28 -31.17 53.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.173 -0.954 . . . . 0.0 109.668 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -57.86 -43.33 85.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 109.465 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.12 -42.71 88.84 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.242 -0.911 . . . . 0.0 109.894 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 85.7 t60 . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 117.854 -1.07 . . . . 0.0 109.379 -179.507 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.563 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.731 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 1' ' ' MET . 31.6 Cg_exo -61.85 145.96 96.77 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.324 2.016 . . . . 0.0 112.21 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.472 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 57.8 t-80 52.0 47.5 24.63 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.313 -0.867 . . . . 0.0 110.322 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -154.51 41.75 0.48 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.18 -0.95 . . . . 0.0 109.278 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.31 140.52 55.95 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.941 . . . . 0.0 109.136 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt 49.94 -167.11 0.03 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.333 -0.855 . . . . 0.0 109.745 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.53 ' NE2' ' SD ' ' A' ' 12' ' ' MET . 61.4 t60 -152.3 70.58 7.59 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.869 . . . . 0.0 109.111 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.42 142.68 98.66 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.063 1.842 . . . . 0.0 111.752 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.23 -43.34 95.22 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.17 -0.956 . . . . 0.0 109.221 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -65.03 -45.36 85.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.39 -0.819 . . . . 0.0 109.4 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.49 -30.39 70.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.352 -0.842 . . . . 0.0 109.406 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.53 ' SD ' ' NE2' ' A' ' 7' ' ' HIS . 20.8 ttt -61.33 -66.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.307 -0.871 . . . . 0.0 109.803 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.32 -41.94 96.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.0 110.157 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.07 -46.32 89.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.963 -1.086 . . . . 0.0 109.862 -179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.4 m -61.27 -44.69 96.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.021 -1.049 . . . . 0.0 110.201 -179.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.29 -43.55 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.161 -0.962 . . . . 0.0 110.529 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.38 -45.21 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.195 -0.94 . . . . 0.0 109.677 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -67.91 -35.39 78.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.327 -0.858 . . . . 0.0 109.848 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.74 -38.31 90.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.193 -0.942 . . . . 0.0 110.113 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.52 ' C ' ' H ' ' A' ' 22' ' ' ARG . 8.3 m -98.4 3.99 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 121.345 -0.847 . . . . 0.0 109.566 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 14.47 0.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.049 -1.032 . . . . 0.0 109.55 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.52 ' H ' ' C ' ' A' ' 20' ' ' VAL . 7.2 mtp180 -46.85 164.41 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.143 -0.973 . . . . 0.0 110.684 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -48.66 96.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.574 0.702 . . . . 0.0 110.117 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.7 m -164.77 -70.67 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.362 -0.836 . . . . 0.0 108.87 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 159.52 120.58 0.57 Allowed Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 24.7 m95 45.87 -121.85 1.06 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.552 -0.97 . . . . 0.0 109.995 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -167.45 117.44 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.046 -1.034 . . . . 0.0 108.762 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.57 131.63 49.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.5 -38.28 66.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.4 -0.813 . . . . 0.0 109.448 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -58.48 -43.35 88.94 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.208 -0.932 . . . . 0.0 108.973 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.36 90.79 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.301 -0.875 . . . . 0.0 109.47 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.42 -49.4 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.158 -0.963 . . . . 0.0 109.217 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.41 -48.38 79.06 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.9 m -62.26 -43.18 99.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.298 -1.119 . . . . 0.0 109.85 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -61.29 -45.26 95.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.337 -0.852 . . . . 0.0 109.685 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.79 -41.14 97.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 109.293 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.19 82.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.245 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -65.39 -45.58 83.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -0.916 . . . . 0.0 109.809 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.432 ' N ' HD21 ' A' ' 39' ' ' ASN . 1.4 m-80 -64.6 -40.51 95.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.154 -0.966 . . . . 0.0 109.651 -179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -88.02 160.08 47.07 Favored Pre-proline 0 N--CA 1.501 2.101 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.394 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.418 ' O ' ' OG ' ' A' ' 42' ' ' SER . 36.3 Cg_endo -62.41 -38.02 56.03 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.917 1.745 . . . . 0.0 111.416 179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 41' ' ' PRO . 56.4 m -170.36 76.88 0.08 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.247 -0.908 . . . . 0.0 109.437 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.5 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 37.4 t80 -59.58 169.56 1.28 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.298 -0.876 . . . . 0.0 109.498 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -127.19 76.05 76.53 Favored Pre-proline 0 N--CA 1.503 2.211 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -73.12 -24.02 17.52 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.556 1.504 . . . . 0.0 111.396 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.52 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.5 mtt85 -65.77 -38.77 89.95 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -61.24 -37.82 84.43 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.467 ' HA ' HH21 ' A' ' 52' ' ' ARG . 78.1 m95 -87.78 6.47 35.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.317 -0.864 . . . . 0.0 109.169 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.39 125.01 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -62.63 -12.67 24.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -1.142 . . . . 0.0 109.543 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . -113.87 -43.24 0.81 Allowed Glycine 0 N--CA 1.505 3.281 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.467 HH21 ' HA ' ' A' ' 48' ' ' TRP . 55.3 ttp85 -66.97 -11.47 56.83 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.567 -0.96 . . . . 0.0 108.882 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.66 -42.1 99.43 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.6 p -62.39 -39.08 92.06 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.381 -0.824 . . . . 0.0 109.086 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' O ' ' A' ' 51' ' ' GLY . 3.7 mp0 -72.72 -30.29 64.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.386 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.8 tpt -64.91 -47.43 77.81 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.973 -1.08 . . . . 0.0 109.503 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -72.93 -18.92 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 109.495 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -61.62 -28.79 69.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.456 -0.777 . . . . 0.0 109.789 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -74.52 -1.25 20.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.158 -0.964 . . . . 0.0 109.262 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.8 mt -100.87 119.35 38.55 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.461 -0.775 . . . . 0.0 108.999 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.46 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.1 p-10 -74.11 -36.77 64.25 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.234 -0.917 . . . . 0.0 111.417 -179.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -72.15 19.18 0.07 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.703 -1.248 . . . . 0.0 110.978 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.46 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.8 mt -136.72 129.59 30.79 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.205 179.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 87.6 m -88.51 133.37 34.17 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 108.778 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -125.72 132.81 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.527 -0.733 . . . . 0.0 109.608 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.548 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 3.3 pt20 -153.62 154.52 34.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -104.41 118.01 35.56 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.357 -0.839 . . . . 0.0 108.822 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.452 ' HG ' ' CD ' ' A' ' 77' ' ' GLU . 15.3 m -87.62 152.31 22.27 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.71 134.21 36.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.384 -0.822 . . . . 0.0 109.613 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.552 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 38.1 t-20 -150.72 93.57 1.97 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.006 -1.059 . . . . 0.0 109.185 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.54 -141.67 41.5 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.9 t -87.0 -7.7 57.9 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.29 -1.123 . . . . 0.0 109.895 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -106.34 127.88 53.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.404 -0.81 . . . . 0.0 109.742 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.7 mt -75.15 133.53 41.47 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.552 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -106.89 120.37 41.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -74.98 146.36 41.73 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.498 -0.751 . . . . 0.0 109.271 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.452 ' CD ' ' HG ' ' A' ' 68' ' ' SER . 97.2 mt-10 -142.03 150.24 41.04 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.365 -0.834 . . . . 0.0 108.927 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.0 pt -140.0 157.22 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 121.467 0.651 . . . . 0.0 109.408 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -149.02 147.93 29.13 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 110.94 16.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.018 -1.051 . . . . 0.0 109.247 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -54.79 -93.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.57 -0.706 . . . . 0.0 109.848 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.439 ' CG ' ' O ' ' A' ' 82' ' ' HIS . 54.9 t-80 48.07 46.46 19.36 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -62.6 -123.76 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.529 -0.732 . . . . 0.0 109.684 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.57 10.4 86.23 Favored Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.3 mt -88.54 -2.23 58.48 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.301 -1.117 . . . . 0.0 109.001 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 59.51 146.69 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.637 0.732 . . . . 0.0 110.174 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -75.05 133.85 41.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.321 -0.862 . . . . 0.0 109.22 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -150.84 149.17 29.37 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.268 -0.895 . . . . 0.0 109.225 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -68.53 135.32 51.38 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.173 -0.954 . . . . 0.0 109.739 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -76.93 -8.73 57.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.501 -0.75 . . . . 0.0 109.567 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -71.44 141.27 50.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.287 -0.883 . . . . 0.0 109.986 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.557 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 10.5 ptp . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 1' ' ' MET . 32.6 Cg_endo -61.53 145.18 98.06 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 122.252 1.968 . . . . 0.0 112.074 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -71.28 132.09 44.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.572 -0.705 . . . . 0.0 109.814 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -166.87 -51.61 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.322 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -7.84 0.16 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.23 -0.919 . . . . 0.0 108.951 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.95 153.36 40.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.32 -0.862 . . . . 0.0 109.663 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 63.74 149.62 0.11 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.754 -0.591 . . . . 0.0 109.756 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -45.45 158.03 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.514 0 C-N-CA 121.62 1.546 . . . . 0.0 112.21 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.09 -40.39 95.67 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -54.39 -41.52 69.33 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.25 -0.906 . . . . 0.0 109.294 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -63.32 -42.91 99.02 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.317 -0.864 . . . . 0.0 109.264 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.8 ttt -62.04 -52.21 64.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.009 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -69.14 -42.13 76.38 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.03 -1.043 . . . . 0.0 110.038 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.8 m -62.05 -45.66 92.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.217 -0.927 . . . . 0.0 109.844 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.5 m -60.74 -42.38 97.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 109.7 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.38 95.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 110.354 -179.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 21' ' ' ALA . 96.5 mt -61.93 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.887 -1.133 . . . . 0.0 109.474 -179.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.73 -34.92 78.91 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.198 -0.939 . . . . 0.0 109.565 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.69 -28.59 68.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.102 -0.998 . . . . 0.0 110.08 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 m -136.73 27.93 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.47 -0.769 . . . . 0.0 109.715 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -62.88 -23.26 67.25 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.839 -1.163 . . . . 0.0 109.025 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 55.52 -168.98 0.08 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.247 0.546 . . . . 0.0 110.378 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -58.92 -48.19 82.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.228 -0.92 . . . . 0.0 110.565 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 m -71.65 151.29 43.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.912 -1.117 . . . . 0.0 109.359 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.01 -0.9 66.42 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -100.27 147.66 25.52 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.64 -0.917 . . . . 0.0 109.508 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.0 126.43 39.53 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.404 ' HG3' ' H ' ' A' ' 31' ' ' ALA . 12.8 pt-20 -63.44 138.89 58.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.235 -0.916 . . . . 0.0 109.638 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.31 -38.42 65.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.455 -0.778 . . . . 0.0 109.241 -178.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.6 m -55.91 -44.46 78.27 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 109.628 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.404 ' H ' ' HG3' ' A' ' 28' ' ' GLU . . . -66.38 -38.95 88.69 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.136 -0.978 . . . . 0.0 109.552 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.8 -50.2 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.001 -1.062 . . . . 0.0 109.369 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.09 97.99 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -59.8 -44.21 94.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.179 -1.189 . . . . 0.0 109.493 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -60.97 -47.69 85.29 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.77 -39.67 94.82 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.388 -0.82 . . . . 0.0 109.021 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.7 -45.52 81.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.14 -0.975 . . . . 0.0 109.591 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.1 -48.54 81.29 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.233 -0.917 . . . . 0.0 109.345 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -65.96 -40.19 91.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.309 -0.87 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.03 151.08 75.69 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.223 -0.923 . . . . 0.0 109.185 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.402 ' O ' ' OG ' ' A' ' 42' ' ' SER . 31.8 Cg_endo -62.3 -35.04 75.87 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.697 1.598 . . . . 0.0 111.57 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 41' ' ' PRO . 36.6 m -171.58 80.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.747 -0.596 . . . . 0.0 109.394 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -88.37 -76.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 63.19 91.13 0.08 OUTLIER Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -62.48 -17.55 58.59 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.374 1.383 . . . . 0.0 111.375 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -56.89 -47.46 80.43 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.364 -0.835 . . . . 0.0 109.026 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.454 ' C ' ' H ' ' A' ' 49' ' ' GLY . 98.1 m-20 -62.12 -33.8 75.14 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 27.1 m95 -75.96 26.55 0.12 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.176 -0.953 . . . . 0.0 109.783 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 51' ' ' GLY . . . 69.45 95.82 0.05 OUTLIER Glycine 0 N--CA 1.492 2.429 0 C-N-CA 119.964 -1.112 . . . . 0.0 110.371 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 49.27 -90.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.41 -1.053 . . . . 0.0 110.457 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -157.76 62.9 0.32 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -58.7 -5.7 0.62 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.405 -1.056 . . . . 0.0 109.053 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 51' ' ' GLY . 8.9 mp -62.59 -39.48 93.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.3 p -55.89 -33.27 64.46 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.527 -0.733 . . . . 0.0 109.795 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -85.54 -33.58 21.72 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 28.2 ttt -66.03 -43.79 86.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.098 -1.001 . . . . 0.0 109.816 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.62 -22.36 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.187 -0.945 . . . . 0.0 109.81 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -62.55 -21.91 65.93 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.489 -0.757 . . . . 0.0 109.202 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -86.21 6.64 28.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.284 -0.885 . . . . 0.0 109.79 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' PHE . 95.4 mt -93.59 -11.64 31.32 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.11 -0.993 . . . . 0.0 109.41 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.547 ' C ' ' H ' ' A' ' 63' ' ' LEU . 22.9 t0 61.3 -61.56 0.09 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.804 -0.56 . . . . 0.0 111.778 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.497 ' N ' ' O ' ' A' ' 60' ' ' LEU . 49.2 p90 -65.82 22.03 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.66 -1.275 . . . . 0.0 112.138 -178.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.547 ' H ' ' C ' ' A' ' 61' ' ' ASP . 7.6 mt -136.59 133.27 36.15 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.261 -0.899 . . . . 0.0 109.181 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.6 m -88.11 138.1 31.75 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.1 t -123.65 132.71 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -131.4 132.24 44.23 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -120.58 123.14 42.13 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -109.95 134.2 52.36 Favored 'General case' 0 N--CA 1.507 2.395 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -72.78 132.61 43.82 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.706 -1.246 . . . . 0.0 108.512 -179.121 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -148.85 91.24 1.84 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.186 -0.946 . . . . 0.0 109.041 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.02 -135.99 28.44 Favored Glycine 0 N--CA 1.489 2.188 0 N-CA-C 109.734 -1.347 . . . . 0.0 109.734 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 87.4 p -86.56 -4.36 59.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.32 -1.106 . . . . 0.0 110.355 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -132.05 136.02 46.92 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.369 -0.832 . . . . 0.0 108.972 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.46 158.39 18.37 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -98.07 103.98 15.97 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.121 -0.987 . . . . 0.0 108.691 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.538 ' HG ' ' N ' ' A' ' 77' ' ' GLU . 9.2 t -76.92 150.73 35.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 109.226 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.538 ' N ' ' HG ' ' A' ' 76' ' ' SER . 96.4 mt-10 -148.1 137.65 22.3 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.063 -1.023 . . . . 0.0 108.545 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 38.3 pt -117.86 145.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 CA-C-O 121.582 0.706 . . . . 0.0 109.728 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -159.02 142.22 14.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.291 -0.88 . . . . 0.0 108.63 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 82' ' ' HIS . 44.8 mt -69.21 137.01 52.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 108.91 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -68.55 7.39 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.609 -0.682 . . . . 0.0 110.119 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.485 ' H ' ' C ' ' A' ' 80' ' ' LEU . 84.4 t60 -56.51 -40.29 74.76 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 109.749 -179.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 83' ' ' ASP . 17.2 p-10 -82.81 8.51 12.13 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.259 -0.901 . . . . 0.0 109.765 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.47 166.15 4.52 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.09 -176.1 0.19 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -1.108 . . . . 0.0 109.609 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 53.99 31.66 13.96 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.666 -0.646 . . . . 0.0 109.671 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 87' ' ' HIS . 84.1 t60 -158.85 43.2 0.25 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.42 -0.8 . . . . 0.0 108.998 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -150.81 9.48 0.6 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.371 -0.831 . . . . 0.0 109.299 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -64.91 -40.0 94.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 109.49 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -67.47 154.32 41.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 110.084 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 52.38 86.47 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.534 -0.729 . . . . 0.0 110.297 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.5 m80 . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 117.965 -1.017 . . . . 0.0 109.913 179.647 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 mtt . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -44.25 135.41 8.63 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 121.474 1.449 . . . . 0.0 112.059 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -78.24 -93.2 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.278 -0.888 . . . . 0.0 109.521 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' C ' ' H ' ' A' ' 6' ' ' LYS . 70.9 mmtt -88.31 -152.29 0.22 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.319 -0.863 . . . . 0.0 109.25 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.413 ' O ' ' NE2' ' A' ' 7' ' ' HIS . 96.4 mt-10 -71.84 37.33 0.06 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 109.568 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 4' ' ' LYS . 36.9 ttmt -78.21 -19.97 52.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.156 -0.965 . . . . 0.0 109.076 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' NE2' ' O ' ' A' ' 5' ' ' GLU . 16.1 m-70 63.7 150.51 0.11 Allowed Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.735 -0.603 . . . . 0.0 109.441 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -43.81 152.74 0.32 Allowed 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.804 1.669 . . . . 0.0 112.299 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.9 -40.99 99.26 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.432 -0.793 . . . . 0.0 109.231 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.8 -50.01 75.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -67.68 -30.85 70.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.869 . . . . 0.0 109.69 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 ttt -64.17 -63.97 1.01 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -63.06 -43.13 99.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.142 -0.974 . . . . 0.0 110.071 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.29 -45.87 91.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.4 m -61.93 -44.24 97.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.164 -0.96 . . . . 0.0 110.237 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.5 -46.2 60.37 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.999 -1.063 . . . . 0.0 110.857 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.48 -46.09 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.101 -0.999 . . . . 0.0 109.921 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -67.79 -36.17 79.95 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.362 -0.836 . . . . 0.0 109.671 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.56 93.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.125 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 m -99.55 -0.52 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.305 -0.872 . . . . 0.0 109.952 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.33 -47.17 86.43 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.031 -1.043 . . . . 0.0 108.613 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' C ' ' H ' ' A' ' 24' ' ' SER . 36.9 mtt180 48.57 34.81 5.28 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.761 0.791 . . . . 0.0 109.987 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 53.48 10.06 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.844 -0.535 . . . . 0.0 109.94 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 22' ' ' ARG . 85.9 p -79.36 165.77 22.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.27 -0.894 . . . . 0.0 109.602 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -56.52 110.33 2.02 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 38.3 m95 46.33 -163.56 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.569 -0.959 . . . . 0.0 110.424 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.82 133.79 40.16 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.53 -0.731 . . . . 0.0 109.179 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -69.15 133.86 48.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.914 . . . . 0.0 109.647 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 36.0 tp -58.38 -39.75 80.46 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.235 -0.916 . . . . 0.0 109.045 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -56.78 -41.3 77.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.254 -0.904 . . . . 0.0 109.257 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.68 88.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.264 -0.898 . . . . 0.0 109.576 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.3 -48.23 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.276 -0.89 . . . . 0.0 109.57 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.71 -46.85 93.37 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.3 m -62.76 -43.26 99.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.19 -1.183 . . . . 0.0 109.877 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE1' ' OD1' ' A' ' 39' ' ' ASN . 58.5 t80 -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 109.655 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.0 mt -63.03 -41.1 99.44 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.294 -0.879 . . . . 0.0 109.168 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.43 -42.67 74.51 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.103 -0.998 . . . . 0.0 109.246 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.93 -42.86 94.31 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.337 -0.852 . . . . 0.0 109.386 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.455 ' OD1' ' CE1' ' A' ' 35' ' ' TYR . 8.2 m120 -88.9 6.5 38.95 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.325 -0.859 . . . . 0.0 109.492 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 36' ' ' LEU . 39.6 t0 -144.94 79.44 11.98 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.36 -0.837 . . . . 0.0 108.8 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -60.57 156.32 42.77 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.197 1.931 . . . . 0.0 111.865 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 p 70.43 -2.98 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.509 -0.744 . . . . 0.0 109.384 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -83.0 134.72 35.04 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.102 -0.999 . . . . 0.0 109.201 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.97 88.32 44.57 Favored Pre-proline 0 N--CA 1.502 2.129 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -54.24 -35.16 82.28 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 121.856 1.704 . . . . 0.0 110.633 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 47.7 mmm-85 -60.19 -36.93 78.74 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.071 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.432 ' C ' ' H ' ' A' ' 49' ' ' GLY . 6.4 m120 -63.3 -37.16 86.16 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.114 -0.991 . . . . 0.0 108.697 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -76.89 19.17 0.3 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.568 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 88.11 156.19 30.24 Favored Glycine 0 N--CA 1.501 2.97 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.473 ' C ' ' H ' ' A' ' 52' ' ' ARG . 58.6 t-80 -78.48 111.64 14.72 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.316 -1.108 . . . . 0.0 109.703 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.451 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 57.35 6.1 2.02 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.473 ' H ' ' C ' ' A' ' 50' ' ' HIS . 40.2 ttp180 -65.46 -1.02 2.2 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.288 -1.125 . . . . 0.0 109.145 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.451 ' H ' ' C ' ' A' ' 51' ' ' GLY . 10.3 mp -62.66 -38.67 91.22 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.7 p -55.24 -33.08 62.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -80.1 -35.96 36.1 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.049 -1.032 . . . . 0.0 109.379 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 tpt -65.42 -45.63 83.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.067 -1.02 . . . . 0.0 109.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.38 -23.86 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.066 -1.021 . . . . 0.0 109.662 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -67.43 -21.69 65.55 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.525 -0.734 . . . . 0.0 109.856 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -91.75 -8.22 47.46 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.072 -1.018 . . . . 0.0 110.543 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mt -94.19 -7.21 42.86 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.986 -1.071 . . . . 0.0 108.197 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 46.86 55.15 8.21 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.742 -0.598 . . . . 0.0 110.931 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -151.51 9.28 0.54 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.892 -1.13 . . . . 0.0 110.575 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mt -137.84 149.03 45.97 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 71.7 m -86.72 122.92 31.3 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.4 t -111.51 118.72 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -144.25 142.63 30.59 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -94.43 152.43 18.61 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.35 -0.844 . . . . 0.0 109.394 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 131.11 21.64 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -73.35 130.49 40.28 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -152.46 155.04 36.72 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 109.618 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.15 -131.18 51.92 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.1 m -113.76 8.68 17.51 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.843 -0.798 . . . . 0.0 109.588 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -147.57 153.56 39.59 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.995 . . . . 0.0 110.061 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.6 tp -63.43 136.95 57.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.486 -0.759 . . . . 0.0 109.237 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -121.88 134.55 54.87 Favored 'General case' 0 N--CA 1.505 2.299 0 CA-C-O 121.644 0.735 . . . . 0.0 109.231 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.4 p -77.86 158.01 29.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.523 -0.736 . . . . 0.0 109.28 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -144.9 144.59 31.17 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 pt -133.07 151.51 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.723 -0.611 . . . . 0.0 109.448 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -155.32 150.54 26.94 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -64.01 131.64 48.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.896 . . . . 0.0 108.609 -179.545 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.0 ptp180 -73.95 38.6 0.11 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.02 -1.05 . . . . 0.0 109.941 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.64 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -78.34 -104.83 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.843 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.64 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 31.6 t70 -63.73 134.31 55.1 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.061 -1.024 . . . . 0.0 109.865 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 167.5 -52.94 0.23 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.3 tp -63.05 -51.31 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.114 -1.227 . . . . 0.0 109.214 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 40.98 -146.6 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.739 -0.601 . . . . 0.0 110.499 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 75.9 m80 50.85 16.9 0.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.918 -1.114 . . . . 0.0 110.203 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -65.38 -41.02 94.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -0.914 . . . . 0.0 109.17 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.425 ' C ' ' H ' ' A' ' 91' ' ' HIS . 47.5 p-80 -71.26 -20.69 62.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.179 -0.951 . . . . 0.0 109.505 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.43 ' ND1' ' O ' ' A' ' 90' ' ' HIS . 57.2 t-80 -73.99 44.0 0.17 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.352 -0.842 . . . . 0.0 109.458 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.425 ' H ' ' C ' ' A' ' 89' ' ' HIS . 86.4 t60 -66.16 -43.08 87.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.9 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.782 -179.705 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.9 mtt . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -61.22 146.5 97.38 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 122.403 2.069 . . . . 0.0 112.167 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -157.13 3.21 0.13 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.279 -0.888 . . . . 0.0 109.03 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.4 mttp 50.93 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.521 -0.737 . . . . 0.0 110.123 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -66.1 -37.24 85.27 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.238 -0.914 . . . . 0.0 109.723 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -91.79 144.09 25.86 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.294 -0.879 . . . . 0.0 109.244 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 52.24 89.12 0.1 Allowed Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 109.105 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -54.68 146.41 54.72 Favored 'Trans proline' 0 N--CA 1.499 1.811 0 C-N-CA 121.731 1.62 . . . . 0.0 112.135 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.23 -41.89 98.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.281 -0.887 . . . . 0.0 108.979 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -59.57 -39.84 85.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 0.0 109.088 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.17 -37.14 86.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.12 -0.988 . . . . 0.0 108.698 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 93.5 mtp -61.22 -48.01 83.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 109.841 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -68.97 -42.02 77.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.228 -0.92 . . . . 0.0 109.913 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 m -62.55 -50.11 72.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.015 -1.053 . . . . 0.0 110.009 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -66.37 -42.62 87.73 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.326 -0.859 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.1 65.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.154 -0.966 . . . . 0.0 111.526 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.88 -44.61 99.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.838 -1.164 . . . . 0.0 109.584 -178.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.493 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -66.37 -30.21 70.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.159 -0.963 . . . . 0.0 109.481 -179.897 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -48.48 75.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.132 -0.98 . . . . 0.0 110.721 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.46 18.01 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 121.352 -0.843 . . . . 0.0 109.841 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.45 -38.58 84.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 109.441 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 22' ' ' ARG . 32.6 mtm180 51.0 72.06 0.39 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 110.773 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 51.78 36.8 18.75 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.429 -0.794 . . . . 0.0 110.203 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.474 ' C ' ' H ' ' A' ' 26' ' ' TRP . 46.5 m -162.51 121.26 2.2 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.077 -1.014 . . . . 0.0 108.836 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.37 0.68 3.56 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.474 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.3 m95 -99.7 145.93 27.08 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.505 -0.997 . . . . 0.0 108.95 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.01 143.85 31.39 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.403 ' N ' ' CD ' ' A' ' 28' ' ' GLU . 35.3 mp0 -68.72 132.39 46.75 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.003 -1.061 . . . . 0.0 109.369 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -55.09 -40.62 70.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.117 -0.989 . . . . 0.0 109.287 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -58.51 -43.76 89.24 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.249 -0.907 . . . . 0.0 108.909 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.03 -37.62 88.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.347 -0.845 . . . . 0.0 109.799 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.0 t -62.05 -49.5 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.11 -43.92 98.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.994 -1.243 . . . . 0.0 109.994 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.1 t -62.69 -45.18 93.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.001 -1.293 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 86.8 t80 -60.96 -48.48 81.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 109.499 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.71 -39.29 93.4 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.426 -0.796 . . . . 0.0 109.112 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.51 82.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.314 -0.866 . . . . 0.0 109.03 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.51 -44.15 91.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.639 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.8 m-80 -64.58 -40.33 95.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.279 -0.888 . . . . 0.0 110.371 -179.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.84 153.21 42.1 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.194 -0.941 . . . . 0.0 109.422 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -47.69 -43.72 27.87 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.19 1.26 . . . . 0.0 111.73 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.2 m -168.97 77.71 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.495 ' CG ' ' N ' ' A' ' 44' ' ' ASP . 45.6 t80 -60.03 -176.19 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.172 -0.955 . . . . 0.0 109.582 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.508 ' O ' ' CD1' ' A' ' 48' ' ' TRP . 3.6 m-20 -145.72 87.97 6.67 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -80.71 -92.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 121.646 1.564 . . . . 0.0 111.245 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.479 ' C ' ' H ' ' A' ' 48' ' ' TRP . 10.3 ptm180 -66.9 -22.3 65.97 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.005 -1.059 . . . . 0.0 109.898 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -51.14 -10.34 0.08 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.072 -1.017 . . . . 0.0 109.795 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.508 ' CD1' ' O ' ' A' ' 44' ' ' ASP . 10.1 m0 -76.59 -25.96 54.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.188 -0.945 . . . . 0.0 108.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 168.06 -168.17 40.62 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -74.45 76.79 1.92 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.391 -1.064 . . . . 0.0 109.787 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.03 17.98 79.18 Favored Glycine 0 N--CA 1.498 2.831 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.453 HH11 ' HG2' ' A' ' 52' ' ' ARG . 75.8 ttt-85 -62.51 -19.03 63.19 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.267 -1.137 . . . . 0.0 108.935 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.32 -44.14 97.18 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -63.03 -35.03 78.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.543 -0.723 . . . . 0.0 109.213 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -77.5 -29.19 52.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.31 -0.868 . . . . 0.0 109.5 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.3 ttp -62.9 -46.4 88.02 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.284 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.67 -30.07 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.196 -0.94 . . . . 0.0 109.554 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.3 -35.95 78.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.187 -0.946 . . . . 0.0 109.8 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -64.34 -35.43 80.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 108.874 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -75.48 138.87 41.88 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.672 -0.642 . . . . 0.0 109.281 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.411 ' C ' ' H ' ' A' ' 63' ' ' LEU . 43.8 m-20 -87.57 -32.72 19.2 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.408 -0.808 . . . . 0.0 111.324 -178.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -76.29 18.0 0.33 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.911 -1.118 . . . . 0.0 110.764 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.4 mt -134.35 127.82 32.44 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.465 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 86.0 m -92.08 135.39 34.01 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.2 t -109.88 130.94 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.483 -0.76 . . . . 0.0 109.146 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -153.4 157.12 39.48 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.0 pm0 -145.86 155.81 43.13 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.051 -1.031 . . . . 0.0 108.558 -179.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 66.1 m -132.4 147.62 52.39 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.626 HH11 ' HG3' ' A' ' 69' ' ' ARG . 9.0 mtm-85 -76.52 140.91 41.34 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.394 0.616 . . . . 0.0 109.79 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -150.94 100.71 2.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.442 -0.786 . . . . 0.0 109.684 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 64.61 -139.09 40.89 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.3 p -89.29 4.62 48.21 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.398 -1.06 . . . . 0.0 109.868 -179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -139.38 114.64 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.468 -0.77 . . . . 0.0 109.542 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -76.06 141.29 42.09 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -102.92 123.07 45.85 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.545 -0.722 . . . . 0.0 109.434 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.8 m -71.18 149.8 45.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.472 -0.768 . . . . 0.0 109.057 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -139.64 153.42 47.31 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 pt -141.39 156.45 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt-85 -137.84 147.96 45.0 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.26 117.9 29.35 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 83' ' ' ASP . 92.6 mtt-85 -64.22 -41.03 97.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 110.184 -178.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.2 t-80 61.81 -72.86 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 81' ' ' ARG . 93.1 m-20 -53.64 -90.27 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.309 -0.869 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 80.33 17.33 74.14 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.403 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 4.1 mm? -86.1 -1.9 57.83 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.354 -1.086 . . . . 0.0 108.761 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.19 127.84 33.48 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.847 . . . . 0.0 109.49 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -80.38 164.05 23.39 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.404 -0.81 . . . . 0.0 109.471 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -150.7 145.76 26.02 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.152 -0.968 . . . . 0.0 108.984 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -87.74 132.24 34.21 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.081 -1.012 . . . . 0.0 109.704 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -66.61 -37.62 85.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.469 -0.77 . . . . 0.0 109.491 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -62.45 -40.51 96.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 84.6 t60 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.89 -1.052 . . . . 0.0 109.507 -179.591 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.9 mtm . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.0 148.52 92.56 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.659 2.239 . . . . 0.0 112.146 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -60.89 -41.52 96.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 108.953 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -157.52 56.93 0.5 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.256 -0.903 . . . . 0.0 109.117 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 48.58 89.26 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.158 -0.964 . . . . 0.0 109.965 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -90.77 31.83 1.03 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.113 -0.992 . . . . 0.0 109.994 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.539 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -73.28 -43.26 7.3 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 109.506 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 22.1 Cg_exo -62.45 143.39 93.24 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 122.144 1.896 . . . . 0.0 112.145 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -65.26 -42.02 93.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.383 -0.823 . . . . 0.0 109.233 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.28 -43.75 97.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 109.607 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.26 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 39.8 tpp -61.58 -53.84 51.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.294 -0.879 . . . . 0.0 109.814 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -70.16 -40.66 74.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.193 -0.942 . . . . 0.0 109.999 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -62.63 -45.55 92.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.068 -1.02 . . . . 0.0 109.661 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.522 ' HG ' ' N ' ' A' ' 16' ' ' ALA . 78.2 p -60.17 -45.03 94.46 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.202 -0.936 . . . . 0.0 110.07 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.522 ' N ' ' HG ' ' A' ' 15' ' ' SER . . . -72.46 -48.06 43.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.232 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.57 -44.61 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.126 -0.983 . . . . 0.0 109.475 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -66.27 -33.51 75.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.209 -0.932 . . . . 0.0 109.889 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.38 -59.15 3.63 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.182 -0.949 . . . . 0.0 110.706 -179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -96.72 29.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.345 -0.847 . . . . 0.0 109.918 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.75 -20.49 2.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.974 -1.079 . . . . 0.0 109.97 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' CG ' HH11 ' A' ' 22' ' ' ARG . 3.7 ttt85 60.21 43.4 13.98 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.594 -0.691 . . . . 0.0 109.24 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 41.58 37.49 0.72 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.782 -0.574 . . . . 0.0 111.192 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.434 ' C ' ' H ' ' A' ' 26' ' ' TRP . 74.6 p -143.82 9.32 1.53 Allowed 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.173 -0.954 . . . . 0.0 109.39 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.87 -43.73 0.98 Allowed Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.437 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 99.4 m95 -75.17 174.87 8.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.3 -1.117 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.35 145.43 22.75 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -71.28 127.44 32.56 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.468 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.03 -42.21 68.89 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.125 -0.984 . . . . 0.0 109.512 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -60.13 -43.29 95.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.227 -0.921 . . . . 0.0 109.069 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.02 81.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.75 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.79 -49.04 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.965 -1.084 . . . . 0.0 109.6 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.66 -49.56 77.3 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.3 m -64.98 -42.22 94.74 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.288 -1.125 . . . . 0.0 110.017 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.449 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 63.5 t80 -60.56 -49.3 78.08 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.258 -0.901 . . . . 0.0 109.558 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.486 ' O ' ' N ' ' A' ' 40' ' ' ASP . 91.6 mt -63.1 -41.95 99.48 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.299 -0.876 . . . . 0.0 109.029 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.62 86.88 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.885 . . . . 0.0 109.288 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.5 -42.89 95.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.435 -0.79 . . . . 0.0 109.678 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.449 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.3 m-80 -85.14 -2.93 58.58 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.226 -0.921 . . . . 0.0 109.531 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 36' ' ' LEU . 23.9 t70 -161.14 75.79 2.5 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.83 -27.34 52.53 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.141 1.894 . . . . 0.0 111.071 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 m -66.37 -8.21 24.08 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.566 -0.709 . . . . 0.0 109.397 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -69.31 134.23 48.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.352 -0.842 . . . . 0.0 109.254 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -117.85 91.04 38.16 Favored Pre-proline 0 N--CA 1.504 2.239 0 O-C-N 121.815 -0.553 . . . . 0.0 109.85 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.04 -17.34 30.85 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.148 1.899 . . . . 0.0 111.021 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -63.98 -35.63 81.32 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.613 0.72 . . . . 0.0 109.229 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -61.36 -36.1 79.26 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CD1' ' N ' ' A' ' 48' ' ' TRP . 48.4 m95 -77.99 3.59 14.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 50' ' ' HIS . . . 70.36 -1.71 18.58 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' ARG . 72.9 t60 59.1 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.822 -0.81 . . . . 0.0 109.923 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.532 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 68.91 -65.24 0.48 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.494 HH11 ' HG3' ' A' ' 52' ' ' ARG . 85.2 mtm-85 -59.58 2.45 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.68 -0.894 . . . . 0.0 109.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.532 ' H ' ' C ' ' A' ' 51' ' ' GLY . 59.1 tp -57.77 -41.04 81.18 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.984 -1.073 . . . . 0.0 108.511 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -60.93 -41.97 97.25 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 108.946 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.9 mm-40 -71.52 -30.22 65.68 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.874 -1.141 . . . . 0.0 109.796 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.9 mmm -63.17 -42.99 99.49 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.873 -1.142 . . . . 0.0 109.544 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.0 m -73.55 -22.92 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.089 -1.007 . . . . 0.0 109.734 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -61.92 -39.08 90.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.046 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -98.2 56.77 1.21 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.371 -0.83 . . . . 0.0 110.003 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 mt -146.14 -6.32 0.57 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.508 ' O ' ' N ' ' A' ' 63' ' ' LEU . 23.0 t70 62.68 -174.15 0.15 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.344 -0.847 . . . . 0.0 110.134 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.488 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 31.1 p90 40.72 20.05 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.592 0 CA-C-O 121.295 0.569 . . . . 0.0 110.904 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.3 mt -141.97 131.63 24.07 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.214 -0.929 . . . . 0.0 109.472 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 81' ' ' ARG . 98.5 m -101.37 134.57 44.25 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.78 131.95 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 O-C-N 121.671 -0.643 . . . . 0.0 109.439 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.437 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 88.8 mt-30 -137.65 149.62 46.73 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -140.21 136.23 33.19 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.0 p -132.88 152.46 51.86 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.486 ' NH1' ' HG2' ' A' ' 69' ' ' ARG . 2.8 mtt-85 -89.11 130.66 35.52 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 75' ' ' HIS . 14.4 p-10 -150.31 114.45 5.11 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.019 -1.051 . . . . 0.0 109.619 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.4 -137.16 34.84 Favored Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.3 p -93.47 -0.95 56.21 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.314 -1.109 . . . . 0.0 110.248 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 68.5 mttm -134.81 139.35 45.03 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.376 -0.828 . . . . 0.0 109.684 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.65 151.08 37.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.232 -0.918 . . . . 0.0 109.077 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.47 ' CG ' ' OE2' ' A' ' 77' ' ' GLU . 19.5 t-160 -100.25 100.9 11.78 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.7 p -83.92 151.91 24.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.432 -0.793 . . . . 0.0 108.901 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.472 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 53.9 mp0 -146.44 153.59 40.63 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 pt -133.16 150.82 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 CA-C-O 121.398 0.618 . . . . 0.0 109.746 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -151.72 154.17 35.79 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 81' ' ' ARG . 60.4 mt -64.03 153.29 37.82 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.579 -0.701 . . . . 0.0 109.401 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 80' ' ' LEU . 9.0 tpp180 85.18 155.45 0.09 Allowed 'General case' 0 N--CA 1.509 2.512 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 15.5 p80 -81.55 -30.29 33.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.244 -0.91 . . . . 0.0 109.074 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -166.95 -53.97 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.202 -0.936 . . . . 0.0 109.267 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.54 -28.22 8.63 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 85' ' ' LEU . 4.0 mm? -78.75 145.39 34.46 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.209 -1.171 . . . . 0.0 109.689 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 57.38 109.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.61 0.719 . . . . 0.0 109.97 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -151.69 165.53 34.1 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 47.3 m170 51.98 -159.31 0.11 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.391 -0.818 . . . . 0.0 109.699 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 51.4 85.8 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.443 -0.786 . . . . 0.0 109.976 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -77.46 151.3 34.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.411 -0.805 . . . . 0.0 109.714 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -146.22 15.71 1.33 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.375 -0.828 . . . . 0.0 109.383 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 73.7 m80 . . . . . 0 N--CA 1.497 1.881 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.132 -179.912 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.5 ptt? . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.41 158.4 55.47 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.339 2.026 . . . . 0.0 112.07 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' O ' ' A' ' 4' ' ' LYS . 77.1 m80 -59.62 -36.47 76.39 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.322 -0.861 . . . . 0.0 109.971 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 3' ' ' HIS . 17.8 ttmm 55.45 108.82 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.708 0.766 . . . . 0.0 110.157 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -149.84 45.57 0.93 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.237 -0.914 . . . . 0.0 109.029 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.1 -43.67 97.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.329 -0.857 . . . . 0.0 109.698 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m80 -98.63 151.75 37.58 Favored Pre-proline 0 N--CA 1.501 2.109 0 O-C-N 121.49 -0.757 . . . . 0.0 109.107 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -46.06 139.03 12.06 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.713 1.608 . . . . 0.0 112.221 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.08 -41.6 99.45 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.326 -0.859 . . . . 0.0 108.798 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.529 ' NE2' ' NE2' ' A' ' 82' ' ' HIS . 57.3 tt0 -57.96 -38.51 76.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 109.153 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -63.09 -42.13 99.55 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.17 -0.956 . . . . 0.0 109.451 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.5 mmm -63.5 -47.41 81.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.677 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -72.65 -43.86 62.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.094 -1.003 . . . . 0.0 110.163 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.54 -50.14 72.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.122 -0.986 . . . . 0.0 110.331 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.3 m -64.84 -42.33 94.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.37 -0.831 . . . . 0.0 110.254 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.18 48.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.54 -44.29 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 109.861 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -65.43 -33.82 76.84 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.73 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -39.43 93.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.012 . . . . 0.0 110.027 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.29 16.91 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.448 -0.782 . . . . 0.0 110.038 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.1 11.41 9.78 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.966 -1.084 . . . . 0.0 108.774 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -46.71 143.53 2.72 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.382 -0.823 . . . . 0.0 110.7 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 t0 56.05 24.66 8.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.848 -0.533 . . . . 0.0 110.169 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.0 m 51.65 -153.53 0.19 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.976 -1.078 . . . . 0.0 109.921 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.82 56.57 4.07 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.491 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 36.6 m95 42.57 -139.48 0.18 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.779 -0.836 . . . . 0.0 110.624 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.71 138.52 11.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.022 -1.048 . . . . 0.0 108.692 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.87 125.37 28.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.127 -0.983 . . . . 0.0 109.286 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.29 -39.27 66.79 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.346 -0.846 . . . . 0.0 109.104 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.1 t -59.94 -43.94 94.68 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.777 -1.202 . . . . 0.0 108.885 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.29 -40.7 94.17 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.0 t -63.47 -51.0 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.132 -0.98 . . . . 0.0 109.678 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.67 -41.85 99.77 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.21 -44.43 96.59 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.15 -1.206 . . . . 0.0 109.694 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.559 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 76.9 t80 -57.45 -43.34 83.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 109.353 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.0 mt -63.29 -38.16 90.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.916 . . . . 0.0 108.93 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.69 -46.69 70.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.009 -1.057 . . . . 0.0 109.708 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -63.37 -40.17 96.52 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.081 -1.012 . . . . 0.0 109.174 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.559 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 80.1 m-20 -90.46 7.2 40.02 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.074 -1.016 . . . . 0.0 109.297 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.2 t0 -164.71 57.83 0.56 Allowed Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 108.884 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.523 ' C ' ' H ' ' A' ' 43' ' ' PHE . 27.7 Cg_endo -60.9 174.09 1.93 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 122.091 1.86 . . . . 0.0 111.947 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 m 66.36 -6.61 0.48 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.523 ' H ' ' C ' ' A' ' 41' ' ' PRO . 47.8 t80 -94.41 -74.44 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.093 -1.004 . . . . 0.0 108.665 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.1 t0 63.91 91.51 0.08 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.432 ' O ' ' N ' ' A' ' 49' ' ' GLY . 51.2 Cg_exo -54.02 -38.32 86.78 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.84 1.694 . . . . 0.0 111.653 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -55.43 -39.11 69.86 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.602 -0.686 . . . . 0.0 109.916 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -49.8 -44.25 49.01 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.924 -1.11 . . . . 0.0 110.454 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.456 ' NE1' ' CZ ' ' A' ' 43' ' ' PHE . 49.0 p-90 -116.22 16.25 15.88 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.521 -0.737 . . . . 0.0 109.222 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -161.38 62.53 0.28 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.521 ' C ' ' H ' ' A' ' 52' ' ' ARG . 49.9 t-80 -69.27 98.9 1.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.515 -0.991 . . . . 0.0 109.1 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.84 -38.92 0.24 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.049 -1.221 . . . . 0.0 110.049 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.521 ' H ' ' C ' ' A' ' 50' ' ' HIS . 83.6 mtm-85 -66.9 -1.62 4.22 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -1.178 . . . . 0.0 109.442 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.32 -42.18 99.16 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.9 p -62.05 -27.48 68.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.24 -0.912 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -81.87 -34.88 29.84 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -62.44 -41.07 98.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.248 -0.908 . . . . 0.0 109.53 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.83 -9.07 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.384 -0.822 . . . . 0.0 109.766 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -58.75 -30.76 67.75 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.158 -0.963 . . . . 0.0 109.698 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.22 -7.63 48.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.068 -1.02 . . . . 0.0 108.984 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.9 mt -93.82 110.63 22.27 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.96 -1.088 . . . . 0.0 108.891 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' A' ' 63' ' ' LEU . 67.1 t0 -65.09 -37.84 88.82 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.345 -0.847 . . . . 0.0 111.133 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -70.98 20.18 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.772 -1.205 . . . . 0.0 111.262 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 61' ' ' ASP . 10.5 mt -138.07 125.64 22.12 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.222 -0.924 . . . . 0.0 108.839 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 84.0 m -87.8 142.44 27.81 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.397 -0.814 . . . . 0.0 108.883 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.6 t -117.17 129.53 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.491 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 49.3 tt0 -155.9 155.93 33.72 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 1.8 pm0 -144.94 146.42 31.97 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.117 -0.989 . . . . 0.0 110.199 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.1 m -167.23 152.39 7.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.311 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.53 170.63 4.08 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.59 167.77 17.8 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 122.198 0.999 . . . . 0.0 111.056 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.69 -150.3 42.47 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.9 p -96.44 6.92 47.75 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.47 -1.018 . . . . 0.0 109.271 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -87.77 150.62 23.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.079 -1.013 . . . . 0.0 109.504 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -123.86 122.9 39.21 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -91.13 137.19 32.56 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.327 -0.858 . . . . 0.0 108.907 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 m -71.21 140.89 50.62 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.811 -1.181 . . . . 0.0 109.13 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -149.87 136.43 19.17 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.271 -0.893 . . . . 0.0 109.144 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 O-C-N 121.339 -0.851 . . . . 0.0 109.8 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -144.32 145.95 32.3 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -74.17 138.66 43.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.28 -0.887 . . . . 0.0 108.947 -179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -65.94 3.59 0.79 Allowed 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.756 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.529 ' NE2' ' NE2' ' A' ' 10' ' ' GLN . 9.2 m-70 -84.59 12.93 6.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.891 -1.131 . . . . 0.0 109.323 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -81.14 -0.9 42.26 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.311 -0.868 . . . . 0.0 109.747 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.17 -173.09 49.97 Favored Glycine 0 N--CA 1.499 2.855 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 87' ' ' HIS . 0.3 OUTLIER -153.88 5.51 0.3 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.312 -1.111 . . . . 0.0 108.956 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -53.43 91.26 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.301 -0.874 . . . . 0.0 110.107 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 85' ' ' LEU . 46.2 p-80 -79.71 -16.66 55.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.342 -0.849 . . . . 0.0 109.156 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -73.56 111.02 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.914 . . . . 0.0 109.049 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 54.0 m170 -83.67 147.44 27.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.279 -0.888 . . . . 0.0 109.953 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -71.46 124.06 23.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.329 -0.857 . . . . 0.0 109.58 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 p-80 -79.99 148.88 30.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.263 -0.898 . . . . 0.0 109.762 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.423 179.837 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -61.91 145.95 96.65 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.534 2.156 . . . . 0.0 112.17 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -159.85 -39.91 0.05 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.314 -0.866 . . . . 0.0 109.406 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.7 pttt -160.7 57.88 0.32 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.2 -0.938 . . . . 0.0 109.616 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -53.58 165.28 0.42 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.15 -0.969 . . . . 0.0 109.537 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -96.98 0.02 48.16 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.188 -0.945 . . . . 0.0 110.183 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.52 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -84.18 -43.65 0.75 Allowed Pre-proline 0 N--CA 1.503 2.179 0 O-C-N 120.98 -1.075 . . . . 0.0 110.027 -179.588 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 16.2 Cg_exo -66.13 140.73 60.62 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.346 2.03 . . . . 0.0 111.928 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 9' ' ' LEU . 9.9 mp -64.79 -43.59 92.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.148 -0.97 . . . . 0.0 109.346 179.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -63.48 -46.86 84.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.124 -0.985 . . . . 0.0 110.056 -179.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.82 -34.87 79.15 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.163 -0.96 . . . . 0.0 109.608 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.7 ttt -60.9 -51.98 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.142 -0.974 . . . . 0.0 109.982 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -69.7 -39.73 76.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.999 -1.063 . . . . 0.0 109.748 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.8 m -60.4 -45.24 94.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.025 -1.047 . . . . 0.0 109.641 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.443 ' HG ' ' N ' ' A' ' 16' ' ' ALA . 78.3 p -61.94 -42.95 99.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.212 -0.93 . . . . 0.0 110.12 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.443 ' N ' ' HG ' ' A' ' 15' ' ' SER . . . -72.85 -46.05 55.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.061 -1.024 . . . . 0.0 110.843 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.49 -46.6 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.046 -1.034 . . . . 0.0 109.723 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -67.83 -34.19 76.24 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 109.843 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.84 92.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.334 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -100.46 5.74 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.317 -0.865 . . . . 0.0 109.702 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -67.14 -7.7 25.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.013 -1.054 . . . . 0.0 108.877 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -61.91 81.38 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.218 -0.926 . . . . 0.0 109.933 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 21' ' ' ALA . 34.7 t70 -173.54 -50.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.0 t -168.87 -30.69 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.772 . . . . 0.0 109.505 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.38 -64.08 0.33 Allowed Glycine 0 N--CA 1.498 2.809 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.546 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 94.2 m95 -54.28 -174.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -1.137 . . . . 0.0 110.166 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.3 136.64 14.03 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.375 -0.828 . . . . 0.0 108.86 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 56.5 mp0 -73.78 132.03 42.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.286 -0.884 . . . . 0.0 109.684 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.24 -40.81 74.73 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.329 -0.857 . . . . 0.0 109.172 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -57.09 -42.92 81.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.036 -1.04 . . . . 0.0 109.111 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.32 90.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 92.9 t -63.13 -48.84 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 109.542 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.73 97.32 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -68.39 -42.01 79.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -1.179 . . . . 0.0 109.892 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 67.7 t80 -61.64 -47.9 83.31 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.152 -0.967 . . . . 0.0 109.57 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.08 -40.82 98.8 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.236 -0.915 . . . . 0.0 108.753 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.34 77.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.104 -0.998 . . . . 0.0 109.512 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -61.63 -46.43 89.85 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.992 -1.068 . . . . 0.0 109.371 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.537 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.7 m-80 -65.15 -39.29 92.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -0.922 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.45 82.99 44.57 Favored Pre-proline 0 N--CA 1.502 2.128 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.27 -29.69 68.45 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.382 2.055 . . . . 0.0 111.1 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 m -67.63 -7.91 30.38 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.544 -0.723 . . . . 0.0 109.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -88.96 123.07 32.96 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.383 -0.823 . . . . 0.0 108.785 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -124.93 82.26 61.29 Favored Pre-proline 0 N--CA 1.502 2.153 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.505 ' O ' ' N ' ' A' ' 49' ' ' GLY . 34.1 Cg_endo -75.59 -33.64 3.89 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 C-N-CA 121.579 1.519 . . . . 0.0 110.947 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.566 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.6 mtt85 -62.85 -43.61 98.34 Favored 'General case' 0 N--CA 1.492 1.656 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -48.22 -31.53 5.93 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -178.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.8 p-90 -133.42 24.81 4.12 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -169.87 55.9 0.2 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -60.32 -47.2 87.03 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.359 -1.083 . . . . 0.0 109.48 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.408 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -134.51 -29.57 0.42 Allowed Glycine 0 N--CA 1.504 3.193 0 N-CA-C 109.112 -1.595 . . . . 0.0 109.112 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -5.1 2.66 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.369 -1.077 . . . . 0.0 109.177 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' A' ' 51' ' ' GLY . 56.4 tp -62.27 -39.47 93.01 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 0.0 108.796 179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.4 t -59.22 -39.9 84.15 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.366 -0.834 . . . . 0.0 109.371 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -75.83 -26.85 57.57 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.089 -1.007 . . . . 0.0 109.886 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.4 mmt -64.73 -43.21 94.11 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.775 -1.203 . . . . 0.0 109.633 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.9 m -69.99 -22.39 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.236 -0.915 . . . . 0.0 109.62 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -62.69 -30.8 71.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 109.355 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -63.22 -34.25 77.25 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.206 -0.934 . . . . 0.0 109.272 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.97 116.05 14.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.356 -0.84 . . . . 0.0 109.334 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 63' ' ' LEU . 90.0 m-20 -64.57 -40.78 96.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.538 -0.726 . . . . 0.0 111.596 -178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -70.57 19.03 0.05 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.634 -1.291 . . . . 0.0 111.349 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.496 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.9 mt -136.39 122.25 19.97 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.33 -0.856 . . . . 0.0 109.05 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 97.5 m -91.55 137.65 32.2 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.63 128.23 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.617 -0.677 . . . . 0.0 109.835 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.546 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 26.7 mt-30 -145.06 146.42 31.85 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 55.4 mp0 -95.92 148.49 22.57 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -127.82 140.23 52.16 Favored 'General case' 0 N--CA 1.503 2.197 0 CA-C-O 121.677 0.751 . . . . 0.0 109.498 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.558 HH11 ' HG2' ' A' ' 69' ' ' ARG . 3.3 mmt-85 -77.01 131.54 38.51 Favored 'General case' 0 N--CA 1.497 1.897 0 CA-C-O 121.42 0.629 . . . . 0.0 109.796 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -149.01 101.51 3.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.537 -0.727 . . . . 0.0 110.298 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 59.03 -142.62 46.35 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.8 t -85.68 1.46 49.28 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -1.202 . . . . 0.0 110.15 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -139.04 117.11 11.73 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.359 -0.838 . . . . 0.0 109.564 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.97 174.1 9.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.508 -0.745 . . . . 0.0 109.033 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -144.24 137.67 27.47 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.206 -0.934 . . . . 0.0 109.574 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.2 t -70.22 150.41 46.46 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.488 -0.757 . . . . 0.0 109.402 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -134.94 150.81 50.44 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 pt -132.72 152.61 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -149.96 152.49 35.04 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.04 109.26 14.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.161 -0.962 . . . . 0.0 109.043 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -69.18 -14.83 63.21 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.47 -0.769 . . . . 0.0 110.016 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 82.2 t60 54.22 80.79 0.11 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -76.95 -1.54 29.18 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.49 -80.4 0.06 OUTLIER Glycine 0 N--CA 1.495 2.626 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.9 mt 52.61 -120.24 1.65 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.375 -1.073 . . . . 0.0 109.779 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -78.92 -6.95 57.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.115 -0.99 . . . . 0.0 109.826 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 49.73 92.39 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.224 -0.922 . . . . 0.0 110.306 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 41.8 t-80 -167.84 87.23 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.4 -0.812 . . . . 0.0 109.443 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -151.4 142.81 23.46 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.1 -1.0 . . . . 0.0 109.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -90.84 118.29 30.13 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.336 -0.853 . . . . 0.0 109.63 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -66.48 -43.88 84.22 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.283 -0.886 . . . . 0.0 109.939 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.3 m80 . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.457 -179.803 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.471 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.75 152.89 79.67 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 122.057 1.838 . . . . 0.0 112.09 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -152.88 150.84 29.72 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.476 -0.765 . . . . 0.0 109.307 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -88.06 1.12 55.01 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.324 -0.86 . . . . 0.0 109.796 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -55.76 -173.51 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.078 -1.014 . . . . 0.0 109.366 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -71.34 119.52 15.59 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.565 ' H ' ' CD2' ' A' ' 7' ' ' HIS . 0.2 OUTLIER -74.37 178.67 1.57 Allowed Pre-proline 0 N--CA 1.499 2.001 0 O-C-N 121.372 -0.83 . . . . 0.0 109.091 -179.071 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 144.62 98.91 Favored 'Trans proline' 0 N--CA 1.499 1.845 0 C-N-CA 121.854 1.703 . . . . 0.0 111.882 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.6 mt -63.99 -42.13 97.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.432 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -64.79 -45.91 84.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.882 . . . . 0.0 109.594 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -66.11 -27.16 67.84 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.271 -0.893 . . . . 0.0 109.15 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.7 tpt -67.5 -63.73 1.0 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.474 -0.766 . . . . 0.0 110.309 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -61.89 -45.81 92.11 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.213 -0.929 . . . . 0.0 110.542 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.426 ' HG1' ' N ' ' A' ' 15' ' ' SER . 61.3 p -59.81 -44.06 94.19 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.995 -1.066 . . . . 0.0 110.408 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.426 ' N ' ' HG1' ' A' ' 14' ' ' THR . 11.6 t -61.11 -46.07 92.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.914 -1.117 . . . . 0.0 110.145 -179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.97 -48.39 45.31 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.386 -0.822 . . . . 0.0 110.837 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.57 -48.07 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.132 -0.98 . . . . 0.0 109.711 -178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -66.91 -25.12 66.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 109.546 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.94 -32.73 51.68 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.024 -1.048 . . . . 0.0 110.564 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.5 ' C ' ' H ' ' A' ' 22' ' ' ARG . 5.9 m -108.32 -0.41 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.959 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.459 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -71.82 16.08 0.13 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.915 -1.116 . . . . 0.0 109.081 179.317 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.8 mtp180 -48.77 -13.02 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.881 -1.137 . . . . 0.0 110.422 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 21' ' ' ALA . 25.6 p30 -74.22 -5.89 44.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.241 -0.912 . . . . 0.0 109.339 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p 68.8 40.45 1.73 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.475 -0.766 . . . . 0.0 109.194 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.74 -140.37 4.12 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -54.63 -170.33 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.902 . . . . 0.0 110.064 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.28 139.76 20.52 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.221 -0.924 . . . . 0.0 108.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -69.93 128.04 34.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 109.343 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.5 -39.27 83.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.427 -0.795 . . . . 0.0 109.186 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.0 m -55.68 -43.82 76.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.921 -1.112 . . . . 0.0 109.402 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.93 -37.88 89.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.319 -0.863 . . . . 0.0 109.205 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 75.7 t -62.92 -48.55 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.219 -0.925 . . . . 0.0 109.74 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.19 -44.93 97.03 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 t -62.98 -45.06 94.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.222 -1.164 . . . . 0.0 109.953 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -61.04 -48.77 80.21 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.985 -1.072 . . . . 0.0 109.438 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 40' ' ' ASP . 93.0 mt -65.01 -41.18 95.56 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.216 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.36 -45.69 80.36 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.871 -1.143 . . . . 0.0 109.631 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -64.65 -42.3 95.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -0.884 . . . . 0.0 110.095 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -86.67 -4.56 59.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.08 -1.013 . . . . 0.0 109.689 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 36' ' ' LEU . 16.4 m-20 -154.48 63.76 4.22 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 43' ' ' PHE . 13.6 Cg_endo -54.76 -166.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.739 1.626 . . . . 0.0 111.859 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t 69.36 -6.24 1.0 Allowed 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -178.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' A' ' 41' ' ' PRO . 1.6 t80 -77.51 135.68 38.25 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.234 -0.916 . . . . 0.0 108.661 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -123.82 84.6 54.1 Favored Pre-proline 0 N--CA 1.503 2.218 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -62.56 -25.35 75.55 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 121.905 1.737 . . . . 0.0 110.649 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.451 ' C ' ' H ' ' A' ' 48' ' ' TRP . 47.7 mmm-85 -66.57 -37.74 85.59 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.951 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -55.55 -7.6 0.28 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.444 -0.785 . . . . 0.0 110.052 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.451 ' H ' ' C ' ' A' ' 46' ' ' ARG . 65.3 m95 -97.27 -15.79 20.64 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.136 -0.977 . . . . 0.0 109.613 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 48' ' ' TRP . . . 49.76 101.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.643 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 82.1 t60 51.03 84.4 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.096 -1.237 . . . . 0.0 110.469 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 159.33 -57.36 0.33 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 45.4 mtm180 48.29 -133.19 1.39 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.487 -1.008 . . . . 0.0 110.225 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.405 ' CD1' ' N ' ' A' ' 53' ' ' LEU . 10.3 mp -63.78 -36.57 84.34 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -49.57 -31.2 9.97 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.554 -0.716 . . . . 0.0 109.377 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -82.69 -40.66 20.33 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 33.6 tpp -62.4 -46.99 86.09 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.191 -0.943 . . . . 0.0 109.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.6 m -64.64 -35.37 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.082 -1.011 . . . . 0.0 109.615 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -57.45 -42.64 82.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 -179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -67.24 -44.37 79.62 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.025 -1.047 . . . . 0.0 109.262 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.3 mt -75.56 143.26 42.51 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.444 -0.785 . . . . 0.0 109.94 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 63' ' ' LEU . 71.4 m-20 -92.85 -150.86 0.28 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.335 -0.853 . . . . 0.0 109.913 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 54.4 p90 42.45 19.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.527 -0.733 . . . . 0.0 111.17 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 61' ' ' ASP . 15.7 mt -132.52 130.07 39.93 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.567 -0.708 . . . . 0.0 109.543 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 88.7 m -89.38 134.63 33.99 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 53.3 t -120.19 130.55 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.317 0 O-C-N 121.553 -0.717 . . . . 0.0 109.109 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -151.25 118.73 6.04 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -124.25 135.73 53.62 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.661 0.743 . . . . 0.0 109.705 -178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.7 t -100.23 125.23 46.38 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 mtt180 -68.73 135.59 51.52 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.026 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -150.0 103.89 3.24 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.483 -0.761 . . . . 0.0 109.737 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.74 -142.49 43.56 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 33.3 t -84.74 -9.03 58.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.284 -1.127 . . . . 0.0 110.247 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -121.45 116.55 24.95 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -89.7 151.17 21.99 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.955 -1.09 . . . . 0.0 108.519 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -99.77 99.95 10.84 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.364 -0.835 . . . . 0.0 109.066 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.5 t -75.37 146.58 40.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.407 -0.808 . . . . 0.0 109.217 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -142.75 143.64 32.31 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.9 pt -133.63 155.65 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-O 121.48 0.657 . . . . 0.0 109.77 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt85 -150.23 150.73 31.97 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.53 121.62 19.97 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.43 ' O ' ' N ' ' A' ' 83' ' ' ASP . 7.7 tpt180 -54.67 135.37 46.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.451 -0.78 . . . . 0.0 110.268 -178.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.471 ' O ' ' ND1' ' A' ' 82' ' ' HIS . 9.9 p80 -57.09 92.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.244 -0.91 . . . . 0.0 108.665 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.43 ' N ' ' O ' ' A' ' 81' ' ' ARG . 97.7 m-20 -83.7 112.53 20.14 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.203 -0.936 . . . . 0.0 109.2 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 178.83 -150.34 9.5 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.1 tt 58.16 94.92 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.372 -1.075 . . . . 0.0 108.982 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -98.56 55.94 1.1 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.403 -0.811 . . . . 0.0 109.637 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 64.1 t-80 52.12 77.95 0.14 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.419 -0.801 . . . . 0.0 110.451 179.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -74.88 149.53 39.49 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.314 -0.866 . . . . 0.0 109.15 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -154.1 148.61 26.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.029 -1.045 . . . . 0.0 109.52 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -148.06 142.34 26.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.36 -0.838 . . . . 0.0 109.429 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.3 m80 48.37 85.7 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.367 -0.833 . . . . 0.0 110.189 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.551 -179.887 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.54 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 37.9 Cg_exo -60.69 126.68 20.41 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.05 1.834 . . . . 0.0 111.826 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.6 mp -65.32 -42.26 93.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.197 -0.94 . . . . 0.0 109.366 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -55.18 -53.05 60.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.285 -0.884 . . . . 0.0 110.151 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -67.06 -39.44 86.88 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.117 -0.989 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 49.1 ttp -61.09 -50.09 74.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.249 -0.907 . . . . 0.0 110.045 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -67.47 -38.32 84.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.974 -1.079 . . . . 0.0 109.316 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -46.52 89.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.052 -1.03 . . . . 0.0 109.788 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.4 m -62.38 -43.13 99.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 110.399 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.76 -43.1 84.97 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.022 -1.049 . . . . 0.0 110.613 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.95 -44.83 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 109.609 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -67.26 -34.07 76.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.36 -0.837 . . . . 0.0 109.763 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.57 94.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.354 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.88 7.19 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.317 -0.864 . . . . 0.0 110.183 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -7.11 15.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.928 -1.107 . . . . 0.0 109.695 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.717 HH11 ' HG2' ' A' ' 22' ' ' ARG . 12.1 mtp85 -71.2 -19.93 62.33 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.31 -0.869 . . . . 0.0 108.883 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -61.34 -50.96 70.83 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.206 -0.934 . . . . 0.0 109.481 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 26' ' ' TRP . 2.5 m -179.78 77.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.544 -0.722 . . . . 0.0 109.263 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.0 -91.14 0.02 OUTLIER Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' A' ' 24' ' ' SER . 70.2 m95 -54.7 -174.07 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.444 -1.033 . . . . 0.0 109.985 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.04 134.29 29.57 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.661 -0.649 . . . . 0.0 109.343 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.36 134.63 48.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.342 -0.849 . . . . 0.0 109.335 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.56 -40.58 75.41 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 109.405 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 t -59.34 -43.14 92.8 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.108 -0.995 . . . . 0.0 109.161 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.22 88.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.252 -0.905 . . . . 0.0 109.617 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.45 -46.95 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.242 -0.911 . . . . 0.0 109.363 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.15 81.74 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.9 m -62.45 -42.57 99.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.162 -1.199 . . . . 0.0 109.688 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.546 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 67.8 t80 -60.75 -48.6 81.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.857 . . . . 0.0 109.387 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.16 -39.08 93.26 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 108.984 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.37 -48.56 80.21 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.99 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -73.15 -51.2 18.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.106 -0.996 . . . . 0.0 110.411 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.546 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 68.8 m-80 -65.43 -39.97 92.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.265 -0.897 . . . . 0.0 109.808 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -123.86 84.66 54.21 Favored Pre-proline 0 N--CA 1.502 2.138 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.32 -28.46 62.76 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.997 1.798 . . . . 0.0 111.333 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.1 p -67.54 -11.83 58.93 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.492 -0.755 . . . . 0.0 109.618 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -75.73 122.63 24.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.12 -0.987 . . . . 0.0 109.122 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -119.58 90.12 42.31 Favored Pre-proline 0 N--CA 1.505 2.278 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -63.28 -20.35 70.34 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.811 1.674 . . . . 0.0 110.776 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -62.71 -38.89 92.25 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.31 -37.97 85.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.296 -0.878 . . . . 0.0 108.725 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.526 ' CD2' ' SD ' ' A' ' 56' ' ' MET . 97.4 m95 -83.95 9.78 11.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.241 -0.912 . . . . 0.0 109.336 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 69.17 151.46 0.45 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.41 ' C ' ' H ' ' A' ' 52' ' ' ARG . 86.7 t60 -79.15 147.69 32.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.354 -1.086 . . . . 0.0 109.549 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.13 -40.01 0.7 Allowed Glycine 0 N--CA 1.494 2.513 0 N-CA-C 110.222 -1.151 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' H ' ' C ' ' A' ' 50' ' ' HIS . 89.4 mtt180 -67.44 -4.89 12.52 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.125 -1.221 . . . . 0.0 108.933 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.66 -40.8 98.2 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -60.53 -42.81 97.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.333 -0.855 . . . . 0.0 109.282 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.406 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 21.8 mp0 -69.15 -27.12 65.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.86 . . . . 0.0 109.565 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.526 ' SD ' ' CD2' ' A' ' 48' ' ' TRP . 46.6 ttp -63.93 -48.73 75.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.932 -1.105 . . . . 0.0 109.481 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.8 m -69.16 -23.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.276 -0.89 . . . . 0.0 109.612 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.8 -28.62 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.485 -0.759 . . . . 0.0 109.378 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -77.49 -4.13 43.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.96 . . . . 0.0 109.567 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.92 109.82 22.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.352 -0.843 . . . . 0.0 108.984 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.449 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.4 m-20 -64.52 -39.37 93.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.495 -0.753 . . . . 0.0 111.192 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -70.29 19.29 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.851 -1.156 . . . . 0.0 111.288 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.449 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.7 mt -138.15 126.61 23.33 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.26 -0.9 . . . . 0.0 108.857 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 43.2 m -88.59 130.97 35.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.6 t -115.6 130.67 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 121.574 -0.704 . . . . 0.0 109.356 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -142.3 153.72 44.12 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.462 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 38.3 mp0 -107.46 119.11 38.51 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.4 m -85.49 155.86 21.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.216 -0.927 . . . . 0.0 108.511 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.83 83.17 4.75 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.543 ' ND2' ' CE1' ' A' ' 75' ' ' HIS . 52.6 t-20 -94.0 104.92 16.95 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.417 -0.802 . . . . 0.0 109.502 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.17 -142.09 44.92 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.62 -6.39 58.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.405 -1.056 . . . . 0.0 109.745 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -106.07 142.08 36.37 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.528 -0.732 . . . . 0.0 109.685 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.2 mt -91.6 123.39 34.97 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.543 ' CE1' ' ND2' ' A' ' 70' ' ' ASN . 48.2 m170 -101.9 135.63 43.12 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.605 -0.684 . . . . 0.0 109.299 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.1 m -79.24 148.48 32.19 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.412 -0.805 . . . . 0.0 109.133 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' A' ' 77' ' ' GLU . 55.6 mp0 -137.34 155.02 49.9 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.6 pt -134.48 153.6 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.734 -0.603 . . . . 0.0 109.386 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -143.58 148.77 36.4 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -85.76 120.46 27.21 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.743 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.492 ' N ' HD13 ' A' ' 80' ' ' LEU . 20.6 mmt85 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.442 -0.786 . . . . 0.0 110.314 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -45.83 138.8 11.48 Favored 'Trans proline' 0 N--CA 1.495 1.568 0 C-N-CA 121.701 1.601 . . . . 0.0 112.066 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.95 -41.48 97.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.409 -0.807 . . . . 0.0 109.436 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -57.77 -46.02 85.14 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.387 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.1 -39.1 93.32 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.214 -0.929 . . . . 0.0 109.344 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.73 -52.58 62.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 110.011 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.96 -41.6 74.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.936 -1.102 . . . . 0.0 109.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -60.5 -44.91 95.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.477 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 m -62.33 -42.22 99.2 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.71 79.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -63.05 -44.81 99.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.129 -0.982 . . . . 0.0 109.404 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.14 -32.04 72.88 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.391 -0.818 . . . . 0.0 109.721 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.89 94.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.0 110.72 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 m -124.12 28.76 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.687 0 O-C-N 121.43 -0.794 . . . . 0.0 110.55 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.91 -34.13 62.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.844 -1.16 . . . . 0.0 110.086 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 23' ' ' ASP . 35.8 mtm-85 44.95 77.14 0.08 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.241 -0.912 . . . . 0.0 109.741 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 22' ' ' ARG . 83.9 m-20 57.69 150.39 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.946 0.879 . . . . 0.0 111.014 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.8 m 57.98 157.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.503 -0.748 . . . . 0.0 110.229 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.73 0.22 86.6 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.12 144.69 27.38 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.313 -1.11 . . . . 0.0 109.587 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.75 139.12 29.27 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.457 -0.777 . . . . 0.0 108.93 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.07 131.22 45.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.165 -0.959 . . . . 0.0 109.745 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.13 -37.5 74.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.509 -0.744 . . . . 0.0 109.589 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -57.19 -44.01 83.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.149 -0.969 . . . . 0.0 109.203 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.9 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.211 -0.931 . . . . 0.0 109.271 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.69 -48.32 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.285 -0.884 . . . . 0.0 109.355 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.38 86.56 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 m -62.94 -42.29 99.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.163 -1.198 . . . . 0.0 109.529 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.551 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 76.8 t80 -60.7 -47.09 87.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.352 -0.843 . . . . 0.0 109.476 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.4 mt -62.51 -42.09 99.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.086 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.66 -42.61 79.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.061 -1.025 . . . . 0.0 109.495 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.31 -42.19 96.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.15 -0.969 . . . . 0.0 109.561 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.551 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 81.0 m-20 -90.09 5.14 48.04 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.193 -0.942 . . . . 0.0 109.287 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 36' ' ' LEU . 49.2 t0 -162.7 73.13 2.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.34 -15.82 49.4 Favored 'Trans proline' 0 N--CA 1.489 1.262 0 C-N-CA 121.226 1.284 . . . . 0.0 111.006 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.1 m -74.49 -7.87 54.45 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -74.75 136.36 41.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.475 -0.765 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.12 92.67 45.78 Favored Pre-proline 0 N--CA 1.506 2.33 0 O-C-N 121.949 -0.469 . . . . 0.0 110.151 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -64.01 -16.31 54.16 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 122.061 1.841 . . . . 0.0 111.882 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.58 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 5.3 mpt_? -64.49 -39.88 94.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -63.48 -37.49 87.5 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -92.85 22.62 4.71 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.282 -0.886 . . . . 0.0 108.742 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.31 160.53 3.15 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -77.99 -18.5 55.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.345 -1.091 . . . . 0.0 109.57 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.43 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -135.83 -19.25 0.73 Allowed Glycine 0 N--CA 1.505 3.244 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -67.88 2.89 1.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.11 -1.229 . . . . 0.0 109.122 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 51' ' ' GLY . 64.4 tp -62.43 -38.35 89.39 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -58.95 -42.56 90.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.17 -0.956 . . . . 0.0 109.145 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -66.17 -30.37 70.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.534 -0.729 . . . . 0.0 109.775 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.7 75.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.856 -1.152 . . . . 0.0 110.046 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 57' ' ' VAL . 17.1 m -71.12 -17.96 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.246 -0.909 . . . . 0.0 109.801 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.67 -29.21 69.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.359 -0.838 . . . . 0.0 109.369 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.03 -32.22 73.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 63.3 mt -71.93 112.8 8.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 109.228 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.3 m-20 -64.4 -40.89 96.68 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.5 -0.75 . . . . 0.0 111.387 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -69.78 20.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.727 -1.233 . . . . 0.0 111.347 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.8 mt -137.82 133.48 34.02 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.222 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.474 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 89.2 m -97.58 135.28 39.63 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -118.11 132.92 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -134.87 117.86 16.33 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -97.65 119.35 36.06 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.548 -0.72 . . . . 0.0 109.191 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.6 m -102.67 122.29 44.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.571 -0.706 . . . . 0.0 109.357 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 133.49 43.77 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.987 -1.07 . . . . 0.0 109.227 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.1 t-20 -149.89 95.68 2.34 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.561 -0.712 . . . . 0.0 109.482 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 62.99 -139.47 44.78 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 t -83.85 -7.33 59.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.403 -1.057 . . . . 0.0 110.387 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -125.59 123.4 38.96 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.504 -0.748 . . . . 0.0 109.293 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -87.06 153.97 21.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.103 -0.998 . . . . 0.0 108.775 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -105.23 99.79 9.4 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.546 -0.721 . . . . 0.0 109.102 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.1 t -74.56 145.85 43.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.608 -0.683 . . . . 0.0 109.343 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -139.91 155.69 47.05 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.1 pt -133.33 151.05 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 CA-C-O 121.252 0.549 . . . . 0.0 109.592 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -151.94 141.48 21.69 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 19.8 mt -74.38 139.01 43.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.283 -0.885 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.474 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 22.4 mmt180 . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.234 -0.916 . . . . 0.0 109.465 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.41 143.22 97.95 Favored 'Trans proline' 0 N--CA 1.502 2.022 0 C-N-CA 121.965 1.776 . . . . 0.0 111.921 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.0 mp -63.35 -43.94 96.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.144 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -63.76 -47.63 80.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.812 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -63.77 -35.76 81.65 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.363 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 ttt -64.15 -61.0 2.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.396 -0.815 . . . . 0.0 110.032 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -65.21 -39.95 93.47 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.15 -0.969 . . . . 0.0 109.974 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -61.12 -45.3 95.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.001 -1.062 . . . . 0.0 109.882 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -61.56 -43.56 98.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.023 -1.048 . . . . 0.0 109.981 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.55 -48.15 35.24 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 110.706 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.443 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.0 mt -63.11 -44.63 99.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 0.0 109.542 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -66.5 -35.16 79.57 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.304 -0.872 . . . . 0.0 109.936 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -38.65 91.97 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.0 110.02 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 m -110.41 11.54 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 121.608 -0.683 . . . . 0.0 109.789 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -59.82 -23.49 63.39 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.879 -1.138 . . . . 0.0 108.713 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 51.77 29.04 5.41 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.6 -0.688 . . . . 0.0 109.85 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 55.4 8.42 0.29 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.374 -0.829 . . . . 0.0 110.5 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.6 p -87.7 -3.52 58.96 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.812 -1.18 . . . . 0.0 108.804 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.66 -59.03 5.0 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.461 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 99.1 m95 -75.4 177.22 6.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.407 -1.055 . . . . 0.0 109.442 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 137.3 9.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.264 -0.898 . . . . 0.0 108.874 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -69.39 125.71 27.54 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.286 -0.884 . . . . 0.0 109.424 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.4 tp -57.73 -40.0 78.59 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.675 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -57.42 -42.27 82.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.064 -1.022 . . . . 0.0 109.132 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.17 89.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.221 -0.924 . . . . 0.0 109.528 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.63 -48.39 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 109.493 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.04 -42.7 99.88 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.1 p -66.25 -40.79 90.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -1.19 . . . . 0.0 109.967 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -61.61 -44.69 96.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.1 mt -61.41 -41.83 97.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.123 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.49 -39.55 84.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.346 -0.846 . . . . 0.0 109.094 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -61.6 -46.09 91.34 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.277 -0.889 . . . . 0.0 109.481 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -88.57 -4.51 58.57 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.145 -0.972 . . . . 0.0 109.167 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 36' ' ' LEU . 4.4 m-20 -153.56 64.28 4.87 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.0 -18.5 63.93 Favored 'Trans proline' 0 N--CA 1.494 1.506 0 C-N-CA 121.5 1.467 . . . . 0.0 111.034 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.0 m -76.14 -7.01 53.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 108.578 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -75.95 164.62 25.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.533 -0.73 . . . . 0.0 109.3 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -131.13 79.61 70.55 Favored Pre-proline 0 N--CA 1.504 2.261 0 O-C-N 121.611 -0.681 . . . . 0.0 110.116 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.17 -36.33 92.94 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.95 1.767 . . . . 0.0 111.142 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.58 -34.32 77.55 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.298 0.57 . . . . 0.0 110.158 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 49' ' ' GLY . 44.6 t30 -60.0 -36.59 77.54 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 108.99 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -78.36 24.56 0.26 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.243 -0.911 . . . . 0.0 109.265 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 74.51 161.8 8.48 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.513 ' C ' ' H ' ' A' ' 52' ' ' ARG . 99.5 m-70 -90.7 123.84 34.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.273 -1.134 . . . . 0.0 109.558 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 69.59 -21.63 0.43 Allowed Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 50' ' ' HIS . 76.2 mtp85 -71.39 -1.88 14.57 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.185 -1.185 . . . . 0.0 109.007 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.9 tp -61.77 -37.71 85.33 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -58.89 -41.97 88.44 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.361 -0.837 . . . . 0.0 109.319 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -65.65 -31.65 72.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.191 -0.943 . . . . 0.0 109.862 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.7 tpt -64.78 -48.6 73.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.87 -1.144 . . . . 0.0 109.962 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.0 m -75.14 -16.27 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.116 -0.99 . . . . 0.0 109.678 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -60.92 -28.13 68.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.424 -0.797 . . . . 0.0 109.688 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -70.37 -3.3 16.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.133 -0.979 . . . . 0.0 109.006 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.0 mt -99.92 124.59 45.41 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.499 -0.75 . . . . 0.0 109.058 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.7 p-10 -73.44 -36.63 65.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.441 -0.787 . . . . 0.0 111.622 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.461 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 51.6 p90 -73.5 18.81 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.684 -1.26 . . . . 0.0 110.907 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.6 mt -136.33 125.03 23.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.318 -0.864 . . . . 0.0 109.165 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.8 m -89.31 141.95 28.09 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.367 -0.833 . . . . 0.0 109.09 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.5 t -116.06 130.35 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.618 0.723 . . . . 0.0 109.396 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.461 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 51.1 tt0 -153.78 150.63 28.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -140.48 127.91 21.32 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.384 -0.823 . . . . 0.0 109.079 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.7 p -81.71 154.45 26.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.889 -1.132 . . . . 0.0 108.724 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.606 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -90.34 132.45 35.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.215 -0.928 . . . . 0.0 108.711 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -150.66 98.82 2.67 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.886 -1.134 . . . . 0.0 109.643 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 55.51 -140.89 39.54 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 62.1 m -86.32 -7.84 58.17 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.26 -1.141 . . . . 0.0 109.655 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -103.14 118.21 36.28 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.339 -0.851 . . . . 0.0 109.491 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.11 134.82 33.47 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -100.87 104.31 15.53 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 m -74.2 148.84 41.26 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.435 -0.791 . . . . 0.0 109.174 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -141.5 152.04 43.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.426 -0.796 . . . . 0.0 108.945 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.3 pt -139.97 152.12 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.659 -0.65 . . . . 0.0 109.437 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -157.04 154.76 30.05 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.93 138.18 58.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.116 -0.99 . . . . 0.0 109.757 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.8 ttp85 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 109.799 -179.487 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.574 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 44.6 Cg_exo -58.41 127.9 26.44 Favored 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 121.095 1.197 . . . . 0.0 112.055 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.53 -40.27 80.81 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.464 -0.773 . . . . 0.0 109.091 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -56.82 -45.63 82.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -0.94 . . . . 0.0 109.307 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -65.0 -36.97 86.13 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.355 -0.841 . . . . 0.0 109.217 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.4 ttp -62.66 -53.74 49.93 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.418 -0.801 . . . . 0.0 110.0 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -70.7 -41.5 71.89 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.917 -1.115 . . . . 0.0 110.123 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.2 m -60.58 -45.89 92.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.883 -1.135 . . . . 0.0 110.119 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -61.41 -45.15 95.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.47 77.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.204 -0.935 . . . . 0.0 111.106 -178.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.1 mt -61.87 -46.96 95.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.114 -0.991 . . . . 0.0 109.451 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.88 -29.23 69.07 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.433 -0.792 . . . . 0.0 109.8 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.22 -42.89 96.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.149 -0.97 . . . . 0.0 110.708 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ARG . 12.6 m -111.98 20.45 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.512 -0.742 . . . . 0.0 109.989 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 2.82 1.31 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.825 -1.172 . . . . 0.0 109.321 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.0 mmt180 61.19 -146.34 0.44 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -59.9 -49.99 75.54 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.626 -0.671 . . . . 0.0 110.178 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t 176.76 87.72 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.284 -0.885 . . . . 0.0 108.804 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.59 -171.2 38.59 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.468 -1.348 . . . . 0.0 109.888 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -58.77 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.67 -0.9 . . . . 0.0 109.556 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.69 142.36 30.01 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.462 -0.774 . . . . 0.0 109.166 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.93 132.85 48.09 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.161 -0.962 . . . . 0.0 110.085 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.27 -39.79 80.14 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.206 -0.934 . . . . 0.0 109.275 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.5 p -55.8 -42.4 75.54 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 109.241 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.39 87.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.582 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.29 -48.29 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.096 -1.003 . . . . 0.0 109.901 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.61 -46.74 93.49 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -64.76 -42.89 94.78 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.109 -1.23 . . . . 0.0 110.094 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -61.21 -48.4 81.67 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.232 -0.917 . . . . 0.0 109.736 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 40' ' ' ASP . 90.1 mt -63.12 -41.97 99.44 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.396 -0.815 . . . . 0.0 109.11 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.33 93.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 108.936 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -64.14 -44.77 91.15 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.295 -0.878 . . . . 0.0 109.707 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -82.99 -8.24 59.58 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.188 -0.945 . . . . 0.0 109.494 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.48 ' N ' ' O ' ' A' ' 36' ' ' LEU . 5.1 m-20 -153.76 77.22 5.83 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.37 -30.29 62.46 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.804 1.669 . . . . 0.0 111.115 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 83.6 p -69.01 -12.47 61.72 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.617 -0.677 . . . . 0.0 109.678 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -76.84 122.85 25.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.975 . . . . 0.0 108.399 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -115.41 96.77 46.82 Favored Pre-proline 0 N--CA 1.506 2.368 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.7 -7.42 20.12 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 CA-C-N 120.187 1.103 . . . . 0.0 111.254 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -62.79 -41.45 99.28 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -62.76 -37.48 86.77 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.439 -0.788 . . . . 0.0 109.151 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -81.51 26.4 0.47 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.274 -0.891 . . . . 0.0 109.359 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 56.75 98.91 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -48.93 -28.66 3.99 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -1.187 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.47 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -96.18 -55.54 1.27 Allowed Glycine 0 N--CA 1.502 3.072 0 N-CA-C 108.771 -1.731 . . . . 0.0 108.771 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -62.94 2.75 0.28 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.39 -1.065 . . . . 0.0 109.607 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 51' ' ' GLY . 57.4 tp -60.44 -42.23 95.69 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.2 t -62.91 -25.93 68.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.489 -0.757 . . . . 0.0 109.739 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -85.09 -34.97 22.1 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 120.976 -1.077 . . . . 0.0 110.056 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.69 -43.58 88.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.887 -1.133 . . . . 0.0 109.872 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 m -63.33 -20.65 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.082 -1.011 . . . . 0.0 109.647 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -69.45 -19.78 63.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.357 -0.839 . . . . 0.0 109.537 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -86.6 0.4 54.51 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.204 -0.935 . . . . 0.0 109.616 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' PHE . 90.5 mt -85.44 -5.48 59.29 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.922 -1.111 . . . . 0.0 109.015 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 63' ' ' LEU . 8.6 m-20 57.85 -65.29 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.526 -0.734 . . . . 0.0 111.958 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 60' ' ' LEU . 52.6 p90 -63.21 19.07 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.63 -1.294 . . . . 0.0 111.999 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 61' ' ' ASP . 8.1 mt -136.21 128.91 30.8 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.061 -1.024 . . . . 0.0 108.875 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 60.8 m -89.26 140.74 29.18 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.8 t -119.18 131.52 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 O-C-N 121.482 -0.761 . . . . 0.0 109.239 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -141.56 151.85 43.56 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.92 120.03 41.13 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -91.57 151.03 20.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.243 -0.911 . . . . 0.0 108.57 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 69' ' ' ARG . 15.0 mtm180 -91.85 114.27 26.76 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -149.99 118.01 6.32 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.267 -0.896 . . . . 0.0 110.161 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.68 -171.11 2.55 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.2 m -78.41 28.94 0.19 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.412 -1.052 . . . . 0.0 109.61 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -144.78 119.56 9.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.301 -0.874 . . . . 0.0 109.076 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 mt -68.12 132.68 47.64 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 m170 -101.31 119.13 38.29 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.557 -0.714 . . . . 0.0 109.229 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.3 t -71.41 149.74 45.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 109.397 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -141.2 148.76 40.47 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -133.64 147.32 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.558 -0.714 . . . . 0.0 109.563 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -157.98 154.02 27.08 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.29 136.85 57.08 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.607 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.6 m80 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -47.84 135.04 23.02 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.353 1.369 . . . . 0.0 111.969 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.9 -42.69 97.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.171 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -59.97 -47.82 84.22 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.251 -0.906 . . . . 0.0 109.437 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.3 -35.44 80.38 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.724 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.58 -50.83 69.73 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.279 -0.888 . . . . 0.0 110.35 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -69.16 -48.68 61.61 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.859 -1.151 . . . . 0.0 110.312 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.4 p -60.65 -43.84 97.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.975 -1.078 . . . . 0.0 110.257 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m -60.64 -44.32 96.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.11 -0.994 . . . . 0.0 110.176 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.54 -41.96 75.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 110.505 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 21' ' ' ALA . 93.6 mt -63.64 -46.18 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.161 -0.962 . . . . 0.0 109.93 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.66 -33.96 77.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.025 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.64 91.71 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.166 -0.959 . . . . 0.0 109.913 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.1 m -101.74 -2.78 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 O-C-N 121.364 -0.835 . . . . 0.0 109.968 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.506 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -62.12 -23.45 66.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.966 -1.084 . . . . 0.0 108.896 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 61.74 -2.97 0.24 Allowed 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.402 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.506 ' H ' ' C ' ' A' ' 21' ' ' ALA . 8.8 p30 -175.11 -101.41 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.799 -1.188 . . . . 0.0 108.827 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.48 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 29.9 t -162.02 91.96 0.82 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.925 -1.109 . . . . 0.0 108.89 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.09 -149.35 8.23 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.418 ' CH2' ' CD ' ' A' ' 66' ' ' GLN . 99.2 m95 -68.04 -178.44 1.01 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.632 -0.922 . . . . 0.0 110.044 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -159.57 149.92 19.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.372 -0.83 . . . . 0.0 108.912 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 40.6 mp0 -76.98 128.42 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.244 -0.91 . . . . 0.0 109.581 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.85 -39.85 78.69 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -55.63 -43.0 75.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.067 -1.021 . . . . 0.0 109.612 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.22 90.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.131 -0.98 . . . . 0.0 109.546 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.3 t -62.7 -48.22 89.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.163 -0.961 . . . . 0.0 109.544 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.85 -48.65 85.19 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -63.2 -42.63 99.35 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.179 -1.189 . . . . 0.0 109.505 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.401 ' CZ ' ' OD1' ' A' ' 39' ' ' ASN . 83.7 t80 -60.12 -45.51 92.75 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.851 . . . . 0.0 109.505 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 40' ' ' ASP . 66.5 mt -61.67 -43.06 99.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.963 . . . . 0.0 109.187 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.46 91.0 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.16 -0.962 . . . . 0.0 109.132 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.9 -44.69 95.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.885 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.401 ' OD1' ' CZ ' ' A' ' 35' ' ' TYR . 33.5 m120 -89.61 2.04 55.21 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.247 -0.908 . . . . 0.0 109.226 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 36' ' ' LEU . 50.0 t0 -162.81 73.8 2.06 Favored Pre-proline 0 N--CA 1.493 1.696 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.03 -14.96 45.51 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.405 1.403 . . . . 0.0 111.306 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 88.2 p -74.95 -8.96 58.01 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -72.94 141.09 47.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.428 -0.795 . . . . 0.0 109.385 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -119.72 92.56 46.53 Favored Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.67 -0.644 . . . . 0.0 109.919 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.09 -19.29 40.38 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.009 1.806 . . . . 0.0 111.525 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -63.72 -36.53 84.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.505 -0.747 . . . . 0.0 109.199 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.02 -36.24 82.91 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.114 -0.991 . . . . 0.0 108.471 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -78.57 7.21 7.11 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.829 . . . . 0.0 109.394 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.92 152.23 0.04 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.449 ' C ' ' H ' ' A' ' 52' ' ' ARG . 59.3 t-80 -78.41 132.15 37.22 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -1.029 . . . . 0.0 109.603 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.57 -32.61 0.85 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.449 ' H ' ' C ' ' A' ' 50' ' ' HIS . 64.5 ttt180 -67.12 -12.01 58.8 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.272 -1.134 . . . . 0.0 108.49 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -61.34 -42.96 99.54 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 108.587 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -62.47 -42.82 99.75 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -69.14 -32.23 71.44 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.953 . . . . 0.0 109.918 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -46.31 88.99 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.095 -1.003 . . . . 0.0 109.783 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.1 -24.74 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.171 -0.955 . . . . 0.0 109.246 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.95 -29.27 69.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.504 -0.747 . . . . 0.0 109.725 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -70.87 -3.04 17.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.951 . . . . 0.0 109.783 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 64.2 mt -102.38 125.01 48.96 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 35.4 p-10 -68.19 -38.7 82.3 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.341 -0.85 . . . . 0.0 111.536 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.419 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 45.2 p90 -76.45 16.0 0.54 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.715 -1.24 . . . . 0.0 110.433 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.408 HD13 ' N ' ' A' ' 64' ' ' THR . 0.7 OUTLIER -133.53 117.04 16.66 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.324 -0.86 . . . . 0.0 109.053 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.408 ' N ' HD13 ' A' ' 63' ' ' LEU . 62.7 m -90.4 141.81 28.36 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.213 -0.929 . . . . 0.0 109.711 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.5 t -126.7 133.79 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CD ' ' CH2' ' A' ' 26' ' ' TRP . 86.6 mt-30 -141.05 137.04 32.62 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -102.37 121.18 41.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.52 -0.737 . . . . 0.0 109.122 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.8 m -92.45 141.74 28.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.279 -0.888 . . . . 0.0 108.998 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.593 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -88.11 90.42 8.38 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.269 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -99.61 106.3 18.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.023 . . . . 0.0 109.676 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.33 -138.76 47.48 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.94 -8.4 57.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.273 -1.133 . . . . 0.0 109.802 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -113.0 122.77 48.61 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.441 -0.787 . . . . 0.0 109.805 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mp -85.01 131.51 34.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -107.7 125.61 51.59 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-O 121.521 0.677 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 t -70.8 154.64 41.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.547 -0.72 . . . . 0.0 109.635 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -137.84 154.86 49.46 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.9 pt -136.99 151.42 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 CA-C-O 121.444 0.64 . . . . 0.0 109.673 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.1 ttp85 -151.19 144.9 25.04 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.4 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -90.49 113.41 25.37 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.301 -0.874 . . . . 0.0 109.236 -178.84 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.4 ' N ' HD13 ' A' ' 80' ' ' LEU . 61.6 ttm-85 . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.938 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 . . . . . 0 N--CA 1.499 1.997 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -45.03 138.02 9.26 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 121.573 1.516 . . . . 0.0 112.386 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 mt -63.58 -40.94 98.25 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.491 -0.755 . . . . 0.0 109.167 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.54 -38.39 77.69 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.472 -0.768 . . . . 0.0 108.947 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -61.73 -42.08 98.49 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.315 -0.865 . . . . 0.0 109.351 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.413 ' SD ' HD22 ' A' ' 36' ' ' LEU . 47.9 mmm -63.54 -44.85 93.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.137 -0.977 . . . . 0.0 109.326 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -69.5 -44.31 71.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.182 -0.949 . . . . 0.0 110.094 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.7 m -62.75 -46.23 89.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.058 -1.026 . . . . 0.0 110.206 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -67.71 -39.1 84.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.283 -0.886 . . . . 0.0 110.202 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -75.47 -48.89 20.64 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.048 -1.032 . . . . 0.0 110.897 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.15 -45.0 99.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.047 -1.033 . . . . 0.0 109.347 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.86 -31.76 72.58 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.383 -0.823 . . . . 0.0 109.71 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.52 96.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.986 -1.071 . . . . 0.0 110.303 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.1 m -118.97 23.94 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.477 -0.764 . . . . 0.0 109.613 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.04 -33.49 70.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.905 -1.122 . . . . 0.0 109.372 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 24' ' ' SER . 20.5 mtm180 51.8 97.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.819 . . . . 0.0 110.476 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 51.07 -82.7 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 110.668 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' ARG . 11.6 p -65.14 157.86 27.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.184 -0.948 . . . . 0.0 109.642 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.1 1.85 78.34 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.411 ' CH2' ' OE1' ' A' ' 66' ' ' GLN . 96.5 m95 -85.03 148.8 25.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.074 -1.25 . . . . 0.0 109.26 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.41 145.68 31.23 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.359 -0.838 . . . . 0.0 109.027 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.14 132.35 46.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.897 . . . . 0.0 109.497 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 53' ' ' LEU . 31.2 tp -56.73 -39.94 74.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.46 -0.775 . . . . 0.0 109.275 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.6 m -58.57 -44.04 89.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.141 -0.974 . . . . 0.0 109.267 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.38 -36.48 80.37 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 109.593 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.42 -48.24 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.232 -0.917 . . . . 0.0 109.312 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.82 -48.78 78.3 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.2 t -62.17 -45.11 94.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.125 -1.22 . . . . 0.0 109.745 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.616 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 74.7 t80 -60.09 -48.53 81.34 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.295 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.413 HD22 ' SD ' ' A' ' 12' ' ' MET . 98.2 mt -65.93 -39.56 90.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 109.382 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.53 75.98 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.057 -1.027 . . . . 0.0 109.824 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -62.44 -41.08 98.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.075 -1.016 . . . . 0.0 109.526 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.616 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 74.2 m-20 -64.36 -40.28 95.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.221 -0.924 . . . . 0.0 109.353 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.28 152.58 58.36 Favored Pre-proline 0 N--CA 1.497 1.922 0 O-C-N 121.19 -0.944 . . . . 0.0 108.683 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -45.97 -43.91 19.4 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.439 1.426 . . . . 0.0 111.312 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.9 m -145.65 -92.82 0.09 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.6 t80 61.81 144.71 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.912 0.863 . . . . 0.0 108.99 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -158.76 94.35 1.87 Allowed Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 121.536 -0.727 . . . . 0.0 109.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -70.35 -22.77 28.9 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 CA-C-N 119.536 0.87 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -66.05 -51.68 56.0 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.321 -0.862 . . . . 0.0 109.423 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -64.0 -11.23 27.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.238 -0.914 . . . . 0.0 110.341 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.451 ' HE3' ' HE ' ' A' ' 52' ' ' ARG . 2.4 m95 -81.16 3.01 25.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.904 -1.123 . . . . 0.0 108.954 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.47 164.2 12.6 Favored Glycine 0 N--CA 1.51 3.623 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -73.24 129.36 37.88 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.314 -1.109 . . . . 0.0 109.83 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . 83.82 -89.87 1.57 Allowed Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.451 ' HE ' ' HE3' ' A' ' 48' ' ' TRP . 1.2 tmt_? 50.14 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.994 -0.709 . . . . 0.0 110.613 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.561 ' N ' ' O ' ' A' ' 51' ' ' GLY . 41.6 tp -49.37 -35.99 20.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.0 t -66.58 -36.53 82.86 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.295 0.569 . . . . 0.0 109.649 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -86.2 -32.44 21.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.995 -1.066 . . . . 0.0 110.244 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.8 mtp -64.38 -38.95 92.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.009 -1.057 . . . . 0.0 108.825 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.2 -26.78 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 120.757 -1.214 . . . . 0.0 110.069 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.35 -40.43 82.17 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.187 -0.946 . . . . 0.0 110.635 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -75.43 -0.47 20.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.923 -1.11 . . . . 0.0 110.263 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.1 mt -102.65 115.42 30.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.234 -0.917 . . . . 0.0 109.267 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.409 ' C ' ' H ' ' A' ' 63' ' ' LEU . 68.0 t0 -65.87 -42.5 90.3 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.355 -0.841 . . . . 0.0 111.473 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -71.87 15.32 0.15 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.868 -1.145 . . . . 0.0 110.806 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.412 HD13 ' N ' ' A' ' 64' ' ' THR . 0.6 OUTLIER -129.23 117.87 21.43 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.391 -0.818 . . . . 0.0 108.954 -179.229 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.412 ' N ' HD13 ' A' ' 63' ' ' LEU . 51.0 m -88.2 144.74 26.27 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.302 -0.874 . . . . 0.0 109.29 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 49.1 t -118.69 130.79 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 CA-C-O 121.531 0.681 . . . . 0.0 109.851 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.411 ' OE1' ' CH2' ' A' ' 26' ' ' TRP . 49.8 tt0 -145.13 152.64 40.37 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.492 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 54.7 mp0 -127.73 118.11 23.18 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 p -79.43 153.73 29.47 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.158 -0.964 . . . . 0.0 108.433 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 69' ' ' ARG . 22.4 mtt180 -96.24 134.6 39.15 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -150.05 101.82 3.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.291 -0.881 . . . . 0.0 109.623 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.12 -140.73 44.49 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.9 p -86.44 -7.88 58.07 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.283 -1.128 . . . . 0.0 109.828 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -118.67 110.45 17.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.596 -0.69 . . . . 0.0 109.627 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.51 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -81.03 149.09 29.41 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.483 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -107.46 129.56 54.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.513 -0.742 . . . . 0.0 109.364 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.6 p -70.62 151.57 44.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.451 -0.781 . . . . 0.0 109.395 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -144.36 156.27 44.16 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.0 pt -138.29 155.02 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.479 -0.763 . . . . 0.0 109.852 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -154.21 146.99 24.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.386 -0.821 . . . . 0.0 108.804 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 69.0 mt -69.05 136.3 52.16 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.218 -0.926 . . . . 0.0 108.634 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 . . . . . 0 N--CA 1.496 1.832 0 O-C-N 121.274 -0.891 . . . . 0.0 109.639 -179.315 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.35 134.94 15.83 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.608 1.539 . . . . 0.0 112.099 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.38 -41.32 96.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.379 -0.826 . . . . 0.0 109.455 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.33 -41.76 72.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.209 -0.932 . . . . 0.0 109.53 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -65.26 -44.51 87.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.15 -0.969 . . . . 0.0 108.635 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 81.3 mtp -62.55 -49.05 76.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.862 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -68.64 -42.89 77.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.001 -1.062 . . . . 0.0 109.829 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -63.2 -48.05 79.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.942 -1.099 . . . . 0.0 109.993 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.0 p -65.93 -40.32 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.09 -1.006 . . . . 0.0 110.223 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.47 -48.66 31.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.094 -1.004 . . . . 0.0 110.74 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.6 mt -62.88 -45.03 99.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 109.495 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -66.37 -32.83 74.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.58 91.61 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.138 -0.977 . . . . 0.0 110.361 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.3 m -117.96 20.15 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.506 -0.746 . . . . 0.0 109.812 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.14 -27.32 66.97 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.056 -1.027 . . . . 0.0 109.662 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 51.21 85.81 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.724 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 25' ' ' GLY . 31.8 t70 52.78 38.8 27.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.07 -1.019 . . . . 0.0 110.499 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 26' ' ' TRP . 4.1 p 62.01 1.24 0.64 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.86 . . . . 0.0 109.688 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 23' ' ' ASP . . . -68.46 76.08 0.27 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.68 ' H ' ' NH2' ' A' ' 79' ' ' ARG . 88.7 m95 40.7 -165.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.896 -0.767 . . . . 0.0 111.216 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.74 133.03 10.85 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -71.38 125.98 28.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 109.577 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.6 tp -54.66 -40.29 68.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 109.265 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -58.53 -43.6 89.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.173 -0.955 . . . . 0.0 109.092 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.28 93.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 109.541 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.95 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.04 -1.037 . . . . 0.0 109.064 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.98 85.71 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.2 t -61.78 -43.37 98.98 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.159 -1.201 . . . . 0.0 109.729 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.567 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 72.2 t80 -59.52 -46.7 88.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.278 -0.889 . . . . 0.0 109.549 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.1 mt -63.24 -40.4 97.33 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.287 -0.883 . . . . 0.0 109.209 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.09 -47.86 65.02 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.94 -1.1 . . . . 0.0 109.58 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -63.89 -41.41 97.71 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 109.298 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.567 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 83.6 m-20 -89.02 8.39 29.92 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.047 -1.033 . . . . 0.0 109.253 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.476 ' N ' ' O ' ' A' ' 36' ' ' LEU . 45.0 t0 -153.38 78.44 5.74 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.335 -0.853 . . . . 0.0 109.173 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.415 ' O ' ' CB ' ' A' ' 42' ' ' SER . 21.1 Cg_exo -62.96 156.52 53.89 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.35 2.033 . . . . 0.0 111.54 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 41' ' ' PRO . 0.9 OUTLIER 75.05 2.68 4.02 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.719 -0.613 . . . . 0.0 109.373 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -93.2 -71.26 0.66 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 55.16 89.42 0.11 Allowed Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.656 -0.652 . . . . 0.0 109.518 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 49' ' ' GLY . 50.8 Cg_exo -54.37 -36.68 88.0 Favored 'Trans proline' 0 N--CA 1.499 1.801 0 C-N-CA 122.246 1.964 . . . . 0.0 111.238 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -58.96 -44.7 91.51 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -47.83 -32.71 6.42 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.345 -0.847 . . . . 0.0 109.921 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 25.5 p-90 -134.37 31.89 3.43 Favored 'General case' 0 N--CA 1.504 2.225 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -61.9 -76.86 0.22 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.468 ' O ' ' ND1' ' A' ' 50' ' ' HIS . 62.7 t-80 55.19 3.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.686 -0.89 . . . . 0.0 110.447 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 49' ' ' GLY . . . 74.35 -18.29 2.2 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.535 ' HG3' HH11 ' A' ' 52' ' ' ARG . 8.9 ptm180 -61.08 -3.92 0.95 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.126 -1.22 . . . . 0.0 109.195 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 51' ' ' GLY . 58.8 tp -62.67 -44.25 96.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.315 -0.866 . . . . 0.0 108.806 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.6 p -65.13 -34.83 79.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.334 -0.854 . . . . 0.0 109.353 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -74.87 -33.53 62.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.024 . . . . 0.0 109.507 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.77 -46.79 86.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.873 -1.142 . . . . 0.0 109.585 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.0 -23.9 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.376 -0.827 . . . . 0.0 109.826 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.16 -32.1 71.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.28 -0.888 . . . . 0.0 109.433 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -70.88 -1.91 13.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.141 -0.974 . . . . 0.0 109.616 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -103.65 122.8 45.77 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.427 -0.795 . . . . 0.0 108.908 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.458 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.2 p-10 -73.89 -37.5 64.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.414 -0.804 . . . . 0.0 111.582 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.458 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 50.2 p90 -72.19 19.29 0.07 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.653 -1.28 . . . . 0.0 110.976 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.435 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.0 mt -137.62 125.86 23.14 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.442 -0.786 . . . . 0.0 108.974 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.4 m -92.5 133.56 35.81 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.01 130.87 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.33 0 CA-C-O 121.545 0.688 . . . . 0.0 109.513 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -149.7 144.4 26.07 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.21 122.68 47.01 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.457 -0.777 . . . . 0.0 109.139 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.9 m -78.77 149.54 32.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 109.403 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.57 126.24 33.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.609 -0.682 . . . . 0.0 109.294 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -149.91 89.62 1.62 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.335 -0.853 . . . . 0.0 109.883 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.36 -140.67 46.67 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.0 p -86.5 -7.55 58.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.197 -1.178 . . . . 0.0 109.992 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -102.98 122.8 45.36 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.3 mt -87.15 129.4 34.95 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -98.12 116.79 31.07 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.388 -0.82 . . . . 0.0 109.228 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.7 m -71.96 144.37 48.92 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.499 -0.751 . . . . 0.0 109.186 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -143.39 150.99 39.88 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.22 149.58 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.609 -0.682 . . . . 0.0 109.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.68 ' NH2' ' H ' ' A' ' 26' ' ' TRP . 6.9 ptp180 -155.42 156.49 35.43 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.5 137.22 46.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.893 . . . . 0.0 109.26 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 . . . . . 0 C--N 1.301 -1.517 0 O-C-N 121.527 -0.733 . . . . 0.0 109.935 -179.974 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 . . . . . 0 N--CA 1.495 1.776 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -49.52 134.68 32.95 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 121.412 1.408 . . . . 0.0 112.148 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.8 mp -64.56 -41.35 96.36 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 108.989 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -56.39 -48.27 77.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 109.81 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.11 -39.2 92.77 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.193 -0.942 . . . . 0.0 109.477 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.5 ttt -62.78 -53.02 60.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -69.94 -41.82 74.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.914 -1.116 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.6 -47.57 83.2 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.078 -1.014 . . . . 0.0 109.855 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.8 m -62.26 -44.27 96.92 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.291 -0.881 . . . . 0.0 110.208 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.52 -48.12 50.8 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.055 -1.028 . . . . 0.0 110.548 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -62.78 -44.1 99.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.026 -1.046 . . . . 0.0 109.461 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.25 -35.33 80.13 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.176 -0.953 . . . . 0.0 110.01 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.43 -57.9 8.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.067 -1.021 . . . . 0.0 110.621 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.4 m -97.06 27.26 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 121.323 -0.861 . . . . 0.0 110.063 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -55.39 -32.78 62.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.961 -1.087 . . . . 0.0 110.08 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.671 ' HG3' HH11 ' A' ' 22' ' ' ARG . 9.4 mtt85 48.65 -94.93 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.973 -1.079 . . . . 0.0 110.096 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' N ' ' O ' ' A' ' 21' ' ' ALA . 67.8 t0 -62.69 -53.27 56.94 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.273 -0.892 . . . . 0.0 111.189 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.45 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 80.9 p -171.39 -160.24 0.17 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.199 -0.938 . . . . 0.0 109.567 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -50.21 -17.78 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -82.43 136.59 34.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.161 -1.2 . . . . 0.0 108.974 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.88 145.34 31.54 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.47 -0.769 . . . . 0.0 109.328 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.02 131.53 48.92 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.27 -0.894 . . . . 0.0 109.551 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 tp -57.2 -39.88 76.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.244 -0.91 . . . . 0.0 109.554 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -57.74 -41.4 81.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.112 -0.993 . . . . 0.0 109.201 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.373 -0.83 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.18 -48.46 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 109.477 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.66 -48.02 84.66 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.91 -43.85 97.69 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.291 -1.123 . . . . 0.0 109.638 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.539 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 87.6 t80 -60.35 -46.36 90.2 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.186 -0.946 . . . . 0.0 109.263 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.53 -38.92 92.99 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.42 -0.8 . . . . 0.0 109.173 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.34 -46.84 76.38 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.536 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -64.47 -44.17 91.87 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.897 . . . . 0.0 109.517 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.539 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.4 m-80 -65.4 -40.14 93.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.864 . . . . 0.0 110.362 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -90.76 167.15 16.97 Favored Pre-proline 0 N--CA 1.505 2.293 0 O-C-N 121.317 -0.865 . . . . 0.0 108.979 -179.265 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.08 -45.06 43.8 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.497 1.465 . . . . 0.0 111.252 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 t -179.03 88.67 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.426 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 36.4 t80 -61.38 174.4 0.73 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.336 -0.852 . . . . 0.0 109.05 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -133.4 76.18 68.43 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.485 -0.759 . . . . 0.0 110.15 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.56 -37.96 94.6 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.194 1.929 . . . . 0.0 111.932 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -60.65 -37.24 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.606 -0.684 . . . . 0.0 109.233 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -59.61 -40.02 86.15 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -82.55 31.47 0.41 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.378 -0.826 . . . . 0.0 108.993 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.92 169.75 4.98 Favored Glycine 0 N--CA 1.495 2.586 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -68.16 -39.42 82.62 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.462 -1.022 . . . . 0.0 109.652 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.6 8.51 2.57 Favored Glycine 0 N--CA 1.504 3.194 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -68.1 -12.27 60.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.169 -1.195 . . . . 0.0 108.639 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.79 -40.38 94.99 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.1 p -60.79 -36.95 80.28 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.349 -0.844 . . . . 0.0 109.032 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -69.37 -36.81 77.22 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.377 -0.827 . . . . 0.0 110.12 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.1 tpt -61.22 -47.81 84.41 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.897 -1.127 . . . . 0.0 109.871 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.45 -25.46 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.119 -0.988 . . . . 0.0 109.394 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -62.4 -32.55 73.39 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.374 -0.829 . . . . 0.0 109.513 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -64.04 -33.44 75.76 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.411 -0.806 . . . . 0.0 108.874 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.02 142.53 47.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.391 -0.818 . . . . 0.0 109.433 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.7 p-10 -90.62 -34.62 15.39 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.282 -0.886 . . . . 0.0 111.273 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.411 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 40.4 p90 -73.04 16.27 0.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.678 -1.264 . . . . 0.0 110.396 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.1 mt -134.06 127.2 31.73 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.1 m -95.16 134.8 37.49 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -118.04 131.27 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 121.608 -0.682 . . . . 0.0 109.468 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -140.24 137.42 34.25 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.461 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 40.3 mp0 -94.57 134.78 36.76 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -0.793 . . . . 0.0 109.291 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.7 m -117.37 129.92 56.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.644 -0.66 . . . . 0.0 109.346 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.429 ' O ' ' ND2' ' A' ' 70' ' ' ASN . 3.4 ptp85 -75.11 138.44 42.08 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.775 -1.203 . . . . 0.0 109.735 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.429 ' ND2' ' O ' ' A' ' 69' ' ' ARG . 30.3 m120 -151.0 92.05 1.77 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.043 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.72 -140.71 48.05 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.8 p -84.43 -6.21 59.36 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.44 -1.035 . . . . 0.0 110.356 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -123.2 97.72 5.55 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.508 -0.745 . . . . 0.0 109.852 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.9 134.52 50.96 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -103.41 128.35 50.56 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.53 -0.731 . . . . 0.0 109.677 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.5 t -71.29 154.35 41.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.633 -0.667 . . . . 0.0 109.601 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -136.56 145.65 45.23 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.3 pt -132.35 157.1 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -143.51 147.54 34.64 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.483 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -82.79 119.24 24.1 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.483 ' N ' HD13 ' A' ' 80' ' ' LEU . 79.4 ttt-85 . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.24 -0.912 . . . . 0.0 109.765 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.55 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.815 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 34.7 Cg_exo -61.52 138.79 78.07 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.217 1.945 . . . . 0.0 111.738 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 9' ' ' LEU . 3.6 mm? -64.96 -41.96 95.02 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.184 -0.948 . . . . 0.0 108.991 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -65.22 -45.64 83.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 109.86 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -64.64 -35.84 82.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.66 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.5 ttt -61.71 -61.43 2.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.29 -0.881 . . . . 0.0 109.852 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -66.86 -40.31 87.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.069 -1.019 . . . . 0.0 110.256 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.9 m -61.75 -46.07 91.21 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.774 -1.204 . . . . 0.0 109.883 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.5 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.039 -1.038 . . . . 0.0 109.966 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.72 -46.75 62.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.479 ' O ' ' N ' ' A' ' 21' ' ' ALA . 98.1 mt -62.56 -45.16 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 109.509 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -67.6 -32.51 73.3 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.093 -1.004 . . . . 0.0 109.093 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.08 -25.71 67.92 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.29 -0.882 . . . . 0.0 109.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.1 m -131.89 19.43 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.423 -0.798 . . . . 0.0 110.335 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.86 -24.75 66.16 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.887 -1.133 . . . . 0.0 108.893 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 51.81 178.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.472 -0.768 . . . . 0.0 110.267 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -68.73 -18.67 64.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.617 -0.677 . . . . 0.0 110.038 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.7 m -74.45 -6.11 46.42 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.901 -1.124 . . . . 0.0 109.469 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -52.51 1.97 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -61.73 178.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -1.13 . . . . 0.0 109.274 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.83 133.13 14.5 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -73.49 132.07 42.49 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.248 -0.907 . . . . 0.0 109.354 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 tp -54.76 -38.45 67.21 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.238 -0.914 . . . . 0.0 109.546 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -57.94 -44.9 87.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.908 -1.12 . . . . 0.0 109.34 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.07 -41.01 99.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.122 -0.986 . . . . 0.0 109.414 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 82.5 t -62.36 -48.14 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.33 -49.17 76.78 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.9 m -61.32 -43.01 99.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.133 -1.216 . . . . 0.0 109.813 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.566 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 69.6 t80 -60.79 -47.35 86.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.253 -0.905 . . . . 0.0 109.385 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 40' ' ' ASP . 80.5 mt -63.0 -40.74 98.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.114 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 41' ' ' PRO . . . -57.51 -48.22 79.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.116 -0.99 . . . . 0.0 109.247 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -61.76 -41.24 97.44 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.204 -0.935 . . . . 0.0 109.132 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.566 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.2 m-80 -80.23 -9.81 59.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.277 -0.889 . . . . 0.0 109.269 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.0 t0 -164.57 71.31 1.55 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.266 -0.896 . . . . 0.0 109.457 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.447 ' N ' ' O ' ' A' ' 37' ' ' ALA . 52.4 Cg_exo -57.14 -30.71 88.07 Favored 'Trans proline' 0 N--CA 1.498 1.788 0 C-N-CA 122.595 2.197 . . . . 0.0 111.489 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -57.11 -13.58 3.08 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.606 -0.684 . . . . 0.0 110.183 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -92.22 -55.51 3.4 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 t0 54.44 85.56 0.19 Allowed Pre-proline 0 N--CA 1.498 1.94 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -54.77 -49.15 17.72 Favored 'Trans proline' 0 N--CA 1.499 1.804 0 C-N-CA 122.328 2.019 . . . . 0.0 112.511 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.498 ' HG2' HH11 ' A' ' 46' ' ' ARG . 66.1 mtp85 -53.19 -52.97 57.11 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.446 -0.784 . . . . 0.0 109.36 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -66.57 -35.09 79.36 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 19.7 t90 -79.34 3.39 18.35 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.193 -0.942 . . . . 0.0 109.777 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.8 126.95 1.01 Allowed Glycine 0 N--CA 1.497 2.714 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -65.91 -45.35 82.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.091 -1.241 . . . . 0.0 109.068 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.8 1.91 0.72 Allowed Glycine 0 N--CA 1.5 2.938 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -66.03 -3.29 5.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.236 . . . . 0.0 109.278 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.2 tp -66.25 -41.6 89.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.122 -0.986 . . . . 0.0 108.668 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 t -59.8 -44.17 94.11 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.438 -0.789 . . . . 0.0 109.66 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -68.09 -30.47 69.65 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.221 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -63.36 -46.97 84.09 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.179 -0.95 . . . . 0.0 109.83 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 57' ' ' VAL . 17.1 m -71.75 -21.09 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.159 -0.963 . . . . 0.0 109.788 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -59.42 -31.99 69.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.147 -0.971 . . . . 0.0 109.557 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -73.47 -3.23 26.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.093 -1.004 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.7 mt -100.22 110.23 22.48 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.368 -0.833 . . . . 0.0 108.862 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.7 t0 -66.12 -37.36 85.53 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 111.523 -179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -71.48 20.03 0.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.727 -1.233 . . . . 0.0 110.981 -178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.2 mt -139.34 127.89 23.05 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.223 -0.923 . . . . 0.0 108.954 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.2 m -90.13 133.2 35.02 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.355 -0.84 . . . . 0.0 109.017 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -120.94 130.73 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.675 -0.641 . . . . 0.0 109.45 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -144.73 153.2 41.44 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.461 -0.774 . . . . 0.0 109.077 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -103.79 144.67 31.17 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.418 -0.801 . . . . 0.0 110.265 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 132.14 44.54 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.638 0.732 . . . . 0.0 109.273 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.668 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -70.21 131.59 44.45 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.542 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 39.7 t-20 -148.69 104.72 3.5 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 120.845 -1.159 . . . . 0.0 109.347 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.28 -140.84 45.45 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 32.1 t -85.22 -3.43 58.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.331 -1.099 . . . . 0.0 110.563 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -134.18 120.39 20.01 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.25 -0.906 . . . . 0.0 109.605 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.75 140.05 58.83 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.678 -0.809 . . . . 0.0 108.828 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.542 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.7 m-70 -102.46 124.32 47.8 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.3 p -71.44 156.63 39.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.491 -0.756 . . . . 0.0 109.035 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.45 149.3 39.07 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.9 pt -142.26 153.92 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.53 -0.731 . . . . 0.0 109.685 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -152.32 152.68 32.41 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.875 . . . . 0.0 108.801 178.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -69.74 135.08 49.33 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.438 ' N ' HD13 ' A' ' 80' ' ' LEU . 41.3 ttp180 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.225 -0.922 . . . . 0.0 109.825 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -55.46 122.66 12.13 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.855 1.703 . . . . 0.0 112.05 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.06 -39.6 93.49 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.647 -0.658 . . . . 0.0 109.527 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -53.84 -48.37 70.01 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.349 -0.845 . . . . 0.0 109.831 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.01 -40.4 94.87 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.221 -0.924 . . . . 0.0 109.341 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.8 ttm -61.85 -51.53 67.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.099 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -70.29 -40.37 74.31 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -61.82 -48.36 80.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.11 -0.994 . . . . 0.0 109.705 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.3 m -62.57 -42.9 99.84 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.155 -0.966 . . . . 0.0 110.262 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.02 -48.29 58.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.035 -1.041 . . . . 0.0 111.034 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.435 ' O ' ' N ' ' A' ' 21' ' ' ALA . 95.3 mt -63.1 -45.35 98.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.093 -1.004 . . . . 0.0 109.789 -178.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.2 -34.24 77.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.706 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.05 -39.1 93.72 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 110.066 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.568 ' C ' ' H ' ' A' ' 22' ' ' ARG . 14.8 m -114.02 16.25 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 121.614 -0.679 . . . . 0.0 110.321 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -63.0 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.68 -1.263 . . . . 0.0 110.041 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.568 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.0 mtp180 -61.13 -142.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.028 -1.045 . . . . 0.0 109.912 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 54.12 -88.5 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.133 -0.979 . . . . 0.0 109.17 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' ARG . 88.5 p -160.58 72.31 0.46 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.74 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.14 -60.88 1.04 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -53.78 178.63 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.324 -1.104 . . . . 0.0 109.821 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -152.8 129.38 10.75 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.13 127.03 29.99 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.141 -0.974 . . . . 0.0 109.47 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.3 tp -57.45 -39.2 75.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.4 -0.812 . . . . 0.0 109.155 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.7 m -57.11 -42.05 80.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.0 109.262 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.51 91.35 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.143 -0.973 . . . . 0.0 109.322 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.9 -47.95 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.17 -0.956 . . . . 0.0 109.224 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.98 -49.79 69.11 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -62.22 -42.33 99.21 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -1.132 . . . . 0.0 109.611 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.3 t80 -60.75 -46.43 90.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.231 -0.918 . . . . 0.0 109.446 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 mt -63.15 -40.01 96.33 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.122 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 109.275 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.04 -43.13 96.46 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 109.595 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 82.9 m-20 -90.51 4.66 50.49 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.242 -0.911 . . . . 0.0 109.136 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 36' ' ' LEU . 21.8 t70 -168.23 77.24 0.85 Allowed Pre-proline 0 N--CA 1.489 1.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.44 -28.14 52.76 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.137 1.891 . . . . 0.0 111.331 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.1 t -63.32 -15.53 57.63 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.462 -0.773 . . . . 0.0 109.587 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -75.01 131.3 40.53 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.227 -0.921 . . . . 0.0 109.085 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 18.6 p30 -138.45 83.07 21.5 Favored Pre-proline 0 N--CA 1.5 2.059 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -58.7 -24.78 72.66 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.464 ' HE ' ' CD2' ' A' ' 50' ' ' HIS . 45.2 mmm-85 -67.42 -42.52 83.06 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.846 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -72.77 -12.13 60.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.291 -0.88 . . . . 0.0 109.153 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -81.7 -2.83 51.89 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.21 -0.931 . . . . 0.0 109.581 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.12 13.81 7.48 Favored Glycine 0 N--CA 1.508 3.484 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.464 ' CD2' ' HE ' ' A' ' 46' ' ' ARG . 17.0 m80 56.24 110.73 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.653 -0.91 . . . . 0.0 110.736 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.75 -6.47 12.35 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -66.93 -7.75 24.41 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.386 -1.067 . . . . 0.0 109.034 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.35 -42.79 99.68 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -62.44 -43.61 98.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 109.539 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 25.9 mp0 -71.54 -27.9 63.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.312 -0.868 . . . . 0.0 109.395 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 44.7 ttp -67.67 -47.12 70.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.096 -1.002 . . . . 0.0 109.804 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.4 m -72.69 -14.85 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.068 -1.02 . . . . 0.0 109.702 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.32 -26.82 65.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.425 -0.797 . . . . 0.0 109.83 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -80.59 -3.69 51.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.05 -1.031 . . . . 0.0 109.418 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -99.07 110.22 22.84 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 63' ' ' LEU . 92.2 m-20 -64.58 -39.02 92.99 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.403 -0.811 . . . . 0.0 111.325 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -70.27 21.16 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.718 -1.239 . . . . 0.0 111.199 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.8 mt -138.21 131.9 31.01 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.192 -0.942 . . . . 0.0 108.978 178.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 86.8 m -93.43 134.83 35.27 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.322 -0.861 . . . . 0.0 108.689 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.6 t -122.62 131.17 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.473 -0.767 . . . . 0.0 109.244 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.0 tt0 -150.68 153.68 36.05 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 67' ' ' GLU . 2.6 pm0 -149.92 154.22 37.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.292 -0.88 . . . . 0.0 109.066 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 70' ' ' ASN . 45.1 t -143.85 132.23 22.09 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.452 -0.78 . . . . 0.0 109.35 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.553 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.8 OUTLIER -64.55 84.0 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' SER . 98.2 m-20 -98.6 142.94 29.55 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.382 -0.824 . . . . 0.0 109.544 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.53 -142.78 42.72 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -100.72 9.6 42.23 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.671 -0.899 . . . . 0.0 109.585 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.442 ' O ' ' ND1' ' A' ' 75' ' ' HIS . 36.6 ttmt -138.16 139.1 39.21 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.34 -0.85 . . . . 0.0 109.971 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.3 tp -66.44 128.95 38.18 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.442 ' ND1' ' O ' ' A' ' 73' ' ' LYS . 64.6 m80 -108.24 104.66 14.11 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.7 m -85.31 150.14 24.97 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 77' ' ' GLU . 55.1 mp0 -144.79 149.26 35.17 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.367 -0.833 . . . . 0.0 108.951 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.8 pt -135.08 152.25 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.725 -0.609 . . . . 0.0 109.467 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -141.04 155.81 46.12 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.48 94.31 6.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.877 . . . . 0.0 108.886 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 . . . . . 0 N--CA 1.505 2.309 0 CA-C-O 121.533 0.682 . . . . 0.0 111.03 179.123 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 m170 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -44.85 129.87 9.78 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.651 1.567 . . . . 0.0 112.086 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.99 -41.77 95.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.493 -0.755 . . . . 0.0 109.361 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.467 ' C ' ' NE2' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -56.33 -48.77 76.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.326 -0.859 . . . . 0.0 109.41 -179.815 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.01 -34.66 78.21 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttt -62.62 -52.56 62.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.301 -0.874 . . . . 0.0 110.328 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.45 -42.01 75.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.908 -1.12 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.0 m -61.63 -44.45 96.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.845 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.1 t -61.67 -45.02 95.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.087 -1.008 . . . . 0.0 110.218 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.3 -46.11 51.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.261 -0.899 . . . . 0.0 110.897 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.05 -45.55 98.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.165 -0.959 . . . . 0.0 109.902 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.22 -32.81 72.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.245 -0.909 . . . . 0.0 109.834 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.13 -40.25 94.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.255 -0.903 . . . . 0.0 110.391 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.477 ' C ' ' H ' ' A' ' 22' ' ' ARG . 10.6 m -100.05 6.31 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 O-C-N 121.253 -0.905 . . . . 0.0 109.742 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.0 8.5 0.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.032 -1.043 . . . . 0.0 109.461 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.477 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.5 mtp180 -61.83 -40.5 95.51 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.078 -1.014 . . . . 0.0 109.859 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.502 ' C ' ' HG ' ' A' ' 24' ' ' SER . 37.0 p-10 -73.89 121.43 20.93 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.076 -1.015 . . . . 0.0 109.549 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' C ' ' A' ' 23' ' ' ASP . 96.3 p 47.38 -91.78 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.389 -0.82 . . . . 0.0 110.445 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 23' ' ' ASP . . . -159.41 -59.04 0.01 OUTLIER Glycine 0 N--CA 1.494 2.558 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -55.27 -177.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.396 -1.061 . . . . 0.0 109.872 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.08 135.06 32.19 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.636 -0.665 . . . . 0.0 109.239 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -71.31 134.83 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.257 -0.902 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 tp -55.6 -40.86 72.6 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 109.287 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 t -59.57 -43.8 93.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.112 -0.992 . . . . 0.0 108.991 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.15 86.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.237 -0.914 . . . . 0.0 109.664 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 73.5 t -61.72 -48.86 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.09 -1.006 . . . . 0.0 109.132 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.15 92.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.465 ' HB2' HH21 ' A' ' 46' ' ' ARG . 7.4 t -61.68 -44.28 97.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.859 -1.377 . . . . 0.0 109.832 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.547 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 71.6 t80 -57.98 -43.91 86.83 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.247 -0.908 . . . . 0.0 109.409 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.3 -40.3 96.98 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.337 -0.852 . . . . 0.0 108.992 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.089 -1.007 . . . . 0.0 109.192 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -61.04 -42.52 98.63 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.303 -0.873 . . . . 0.0 109.497 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.547 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.1 m-80 -83.01 -6.07 59.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.275 -0.891 . . . . 0.0 108.714 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -153.69 74.01 6.51 Favored Pre-proline 0 N--CA 1.495 1.799 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.25 -35.31 73.51 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.288 1.992 . . . . 0.0 111.204 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.6 p -66.57 -10.98 50.88 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.539 -0.725 . . . . 0.0 109.415 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -88.36 148.32 24.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.277 -0.889 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -129.45 78.18 76.1 Favored Pre-proline 0 N--CA 1.502 2.145 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 49' ' ' GLY . 41.7 Cg_endo -78.21 -27.3 5.6 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.724 1.616 . . . . 0.0 110.83 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.465 HH21 ' HB2' ' A' ' 34' ' ' SER . 25.2 mmt180 -65.02 -45.25 86.3 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.439 -0.788 . . . . 0.0 109.192 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -48.6 -30.85 5.81 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.319 -0.863 . . . . 0.0 110.295 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 15.0 p-90 -135.62 25.19 3.42 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.252 -0.905 . . . . 0.0 109.829 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -87.43 -11.54 68.81 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.181 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -66.5 -40.74 89.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.006 -1.291 . . . . 0.0 109.425 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.646 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . -139.89 -147.94 5.11 Favored Glycine 0 N--CA 1.502 3.073 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.414 ' HG2' HH11 ' A' ' 52' ' ' ARG . 94.9 mtt-85 49.0 -74.84 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 CA-C-N 117.53 0.665 . . . . 0.0 110.535 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.646 ' N ' ' O ' ' A' ' 51' ' ' GLY . 64.7 tp -51.18 -41.67 60.36 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.098 -1.001 . . . . 0.0 108.571 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.1 p -63.98 -29.66 70.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.484 -0.76 . . . . 0.0 109.137 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -85.87 -29.3 23.8 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.265 -0.897 . . . . 0.0 109.562 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.7 mtt -63.61 -41.4 98.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.158 -0.964 . . . . 0.0 109.15 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.7 m -61.47 -41.42 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.242 -0.911 . . . . 0.0 108.93 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.65 -31.98 72.36 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.692 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -89.56 -2.38 58.32 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.109 -0.994 . . . . 0.0 110.417 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 62' ' ' PHE . 6.3 mt -88.09 5.4 41.32 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.203 -0.936 . . . . 0.0 109.196 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.509 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.6 t0 56.55 -75.77 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.781 -0.574 . . . . 0.0 111.793 178.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 60' ' ' LEU . 47.6 p90 -65.52 26.95 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.623 -1.298 . . . . 0.0 111.848 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 61' ' ' ASP . 1.2 mm? -124.86 126.81 46.15 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 120.948 -1.095 . . . . 0.0 108.351 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.1 m -88.45 141.93 28.13 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.54 131.14 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.503 -0.748 . . . . 0.0 109.371 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -145.53 155.3 42.99 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 38.8 mp0 -114.58 123.95 50.63 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 89.8 p -109.44 150.92 27.38 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 130.54 34.76 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.589 0.709 . . . . 0.0 109.367 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -152.1 112.81 4.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.414 -0.804 . . . . 0.0 109.263 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.41 -144.64 47.41 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.4 p -92.92 1.92 57.05 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.509 -0.994 . . . . 0.0 109.864 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -123.71 135.94 54.16 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.487 -0.758 . . . . 0.0 109.935 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 73.6 mt -75.41 132.42 40.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -104.89 117.03 33.02 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.569 -0.707 . . . . 0.0 109.114 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.0 t -68.12 139.28 56.17 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.371 -0.83 . . . . 0.0 109.476 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -126.26 143.74 51.04 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.9 pt -135.37 158.44 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.742 -0.599 . . . . 0.0 110.07 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -147.98 139.8 23.94 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.38 106.76 0.57 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.635 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 109.957 -179.15 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.67 143.47 95.01 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.317 2.012 . . . . 0.0 112.192 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -63.8 -41.2 97.96 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.88 -39.6 81.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.259 -0.901 . . . . 0.0 109.255 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -61.82 -43.54 98.65 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.3 -0.875 . . . . 0.0 109.129 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.2 mtt -63.89 -46.76 83.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.208 -0.933 . . . . 0.0 109.868 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -69.74 -44.12 70.91 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.228 -0.92 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.6 m -63.28 -47.2 83.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.937 . . . . 0.0 110.147 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -66.5 -40.27 89.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 110.133 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.059 -1.026 . . . . 0.0 110.603 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -62.71 -44.45 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.349 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.73 -33.54 75.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 110.063 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 -58.92 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.134 -0.979 . . . . 0.0 110.467 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -98.31 29.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.314 -0.866 . . . . 0.0 109.453 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -48.91 -33.6 11.11 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.011 -1.056 . . . . 0.0 109.659 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.758 HH11 ' HG2' ' A' ' 22' ' ' ARG . 40.8 ttp85 51.92 -87.48 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.466 -0.771 . . . . 0.0 110.605 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 21' ' ' ALA . 95.9 m-20 -60.74 -88.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.892 -1.13 . . . . 0.0 109.989 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 26' ' ' TRP . 31.6 t -167.99 97.95 0.45 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.099 -1.001 . . . . 0.0 109.363 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.5 -25.69 2.38 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.402 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.2 m95 -91.51 142.69 27.38 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.209 -1.171 . . . . 0.0 109.607 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.48 141.7 29.75 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.305 -0.872 . . . . 0.0 108.945 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -67.54 130.36 42.8 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.291 -0.881 . . . . 0.0 109.728 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.72 -39.47 71.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.349 -0.844 . . . . 0.0 109.225 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 t -58.6 -44.0 89.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.098 -1.001 . . . . 0.0 109.173 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.32 87.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.154 -0.966 . . . . 0.0 109.684 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.09 -48.98 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.078 -1.014 . . . . 0.0 109.387 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.47 -44.39 97.73 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -69.64 -40.33 76.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 109.804 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.71 -48.52 80.39 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.249 -0.907 . . . . 0.0 109.637 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.0 mt -63.09 -42.14 99.55 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.232 -0.918 . . . . 0.0 108.954 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.64 87.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.907 . . . . 0.0 109.084 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -64.97 -42.85 94.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 109.383 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -84.78 -4.64 59.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.171 -0.955 . . . . 0.0 109.352 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 36' ' ' LEU . 7.9 m-20 -154.74 74.24 5.78 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.278 -0.889 . . . . 0.0 108.884 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.0 -35.18 80.09 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.377 2.051 . . . . 0.0 111.286 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.8 t -65.4 -12.47 52.58 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.47 136.12 56.75 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.301 -0.874 . . . . 0.0 108.784 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.438 ' O ' ' ND2' ' A' ' 47' ' ' ASN . 66.2 m-20 -120.45 92.26 47.41 Favored Pre-proline 0 N--CA 1.502 2.141 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.17 -8.31 21.85 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 121.175 1.25 . . . . 0.0 111.49 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.758 HH11 ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -66.85 -41.9 86.63 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.566 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.556 ' O ' ' NH2' ' A' ' 52' ' ' ARG . 17.1 p30 -70.48 -22.09 62.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.528 -0.733 . . . . 0.0 109.549 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.523 ' CE3' ' SD ' ' A' ' 56' ' ' MET . 89.7 m95 -93.61 3.81 54.93 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.131 -0.981 . . . . 0.0 109.112 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.35 138.74 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -68.22 -36.27 79.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.139 -1.212 . . . . 0.0 110.267 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.62 -34.83 5.87 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.556 ' NH2' ' O ' ' A' ' 47' ' ' ASN . 46.3 ttp180 -63.93 -17.51 63.31 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.547 -0.973 . . . . 0.0 109.247 -178.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.3 tp -62.9 -43.05 99.83 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -64.83 -27.6 68.99 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.499 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -80.86 -34.28 33.86 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.139 -0.976 . . . . 0.0 109.4 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.523 ' SD ' ' CE3' ' A' ' 48' ' ' TRP . 47.3 ttp -61.48 -45.75 92.93 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -60.94 -31.3 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.28 -0.888 . . . . 0.0 109.487 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -64.6 -30.65 71.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.349 -0.844 . . . . 0.0 109.896 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -86.94 -7.04 58.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.998 -1.064 . . . . 0.0 110.164 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.7 mt -101.36 127.08 48.16 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.322 -0.861 . . . . 0.0 109.051 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' CG ' ' A' ' 62' ' ' PHE . 97.3 m-20 -65.24 -168.91 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.244 -0.91 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CG ' ' O ' ' A' ' 61' ' ' ASP . 54.5 p90 42.89 16.51 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 122.028 -0.42 . . . . 0.0 111.427 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -132.83 116.37 16.44 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.247 -0.908 . . . . 0.0 108.792 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.407 ' N ' HD13 ' A' ' 63' ' ' LEU . 85.1 m -91.98 141.02 29.08 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.5 t -114.84 130.01 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-O 121.525 0.679 . . . . 0.0 109.621 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -154.23 143.74 21.51 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -108.92 152.25 25.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.646 -0.659 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.5 m -127.38 131.37 50.34 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.605 ' N ' ' HD3' ' A' ' 69' ' ' ARG . 0.1 OUTLIER -77.52 136.63 38.34 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.462 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -149.56 101.2 3.07 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.154 -0.966 . . . . 0.0 109.367 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.73 -141.77 47.81 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.0 p -86.97 -3.97 59.13 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.488 -1.007 . . . . 0.0 109.953 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.508 ' HD2' ' HE2' ' A' ' 75' ' ' HIS . 37.8 ttmt -115.71 121.81 43.62 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.675 -0.641 . . . . 0.0 110.143 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 tt -82.46 130.11 35.04 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.508 ' HE2' ' HD2' ' A' ' 73' ' ' LYS . 38.0 m80 -110.22 124.55 51.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.517 -0.739 . . . . 0.0 109.694 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.5 m -72.01 151.92 42.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.518 -0.739 . . . . 0.0 109.294 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -138.78 151.74 47.33 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.1 pt -137.17 156.45 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.623 0.725 . . . . 0.0 109.525 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -157.81 151.04 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.1 mt -70.33 139.52 52.03 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.221 -0.925 . . . . 0.0 109.935 -179.34 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.506 ' HE2' ' CE ' ' A' ' 12' ' ' MET . 61.4 t60 . . . . . 0 N--CA 1.497 1.905 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.42 142.68 98.66 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.063 1.842 . . . . 0.0 111.752 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.23 -43.34 95.22 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.17 -0.956 . . . . 0.0 109.221 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -65.03 -45.36 85.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.39 -0.819 . . . . 0.0 109.4 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.49 -30.39 70.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.352 -0.842 . . . . 0.0 109.406 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.506 ' CE ' ' HE2' ' A' ' 7' ' ' HIS . 20.8 ttt -61.33 -66.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.307 -0.871 . . . . 0.0 109.803 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.32 -41.94 96.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.0 110.157 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.07 -46.32 89.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.963 -1.086 . . . . 0.0 109.862 -179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.4 m -61.27 -44.69 96.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.021 -1.049 . . . . 0.0 110.201 -179.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.29 -43.55 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.161 -0.962 . . . . 0.0 110.529 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.38 -45.21 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.195 -0.94 . . . . 0.0 109.677 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -67.91 -35.39 78.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.327 -0.858 . . . . 0.0 109.848 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.74 -38.31 90.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.193 -0.942 . . . . 0.0 110.113 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 22' ' ' ARG . 8.3 m -98.4 3.99 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 121.345 -0.847 . . . . 0.0 109.566 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 14.47 0.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.049 -1.032 . . . . 0.0 109.55 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 20' ' ' VAL . 7.2 mtp180 -46.85 164.41 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.143 -0.973 . . . . 0.0 110.684 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -48.66 96.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.574 0.702 . . . . 0.0 110.117 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.7 m -164.77 -70.67 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.362 -0.836 . . . . 0.0 108.87 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 159.52 120.58 0.57 Allowed Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 24.7 m95 45.87 -121.85 1.06 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.552 -0.97 . . . . 0.0 109.995 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -167.45 117.44 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.046 -1.034 . . . . 0.0 108.762 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.57 131.63 49.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.5 -38.28 66.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.4 -0.813 . . . . 0.0 109.448 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -58.48 -43.35 88.94 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.208 -0.932 . . . . 0.0 108.973 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.36 90.79 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.301 -0.875 . . . . 0.0 109.47 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.42 -49.4 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.158 -0.963 . . . . 0.0 109.217 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.41 -48.38 79.06 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.9 m -62.26 -43.18 99.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.298 -1.119 . . . . 0.0 109.85 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.472 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 66.6 t80 -61.29 -45.26 95.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.337 -0.852 . . . . 0.0 109.685 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.79 -41.14 97.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 109.293 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.19 82.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.245 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -65.39 -45.58 83.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -0.916 . . . . 0.0 109.809 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.472 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 3.0 m120 -64.6 -40.51 95.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.154 -0.966 . . . . 0.0 109.651 -179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -88.02 160.08 47.07 Favored Pre-proline 0 N--CA 1.501 2.101 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.394 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.41 -38.02 56.03 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.917 1.745 . . . . 0.0 111.416 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.4 m -170.36 76.88 0.08 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.247 -0.908 . . . . 0.0 109.437 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.5 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 37.4 t80 -59.58 169.56 1.28 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.298 -0.876 . . . . 0.0 109.498 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -127.19 76.05 76.53 Favored Pre-proline 0 N--CA 1.503 2.211 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -73.12 -24.02 17.52 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.556 1.504 . . . . 0.0 111.396 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.548 ' HG3' HH11 ' A' ' 46' ' ' ARG . 80.5 mtt85 -65.77 -38.77 89.95 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -61.24 -37.82 84.43 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.507 ' HA ' HH21 ' A' ' 52' ' ' ARG . 78.1 m95 -87.78 6.47 35.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.317 -0.864 . . . . 0.0 109.169 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.39 125.01 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -62.63 -12.67 24.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -1.142 . . . . 0.0 109.543 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . -113.87 -43.24 0.81 Allowed Glycine 0 N--CA 1.505 3.281 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.507 HH21 ' HA ' ' A' ' 48' ' ' TRP . 55.3 ttp85 -66.97 -11.47 56.83 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.567 -0.96 . . . . 0.0 108.882 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.66 -42.1 99.43 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.6 p -62.39 -39.08 92.06 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.381 -0.824 . . . . 0.0 109.086 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' O ' ' A' ' 51' ' ' GLY . 3.7 mp0 -72.72 -30.29 64.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.386 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.8 tpt -64.91 -47.43 77.81 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.973 -1.08 . . . . 0.0 109.503 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -72.93 -18.92 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 109.495 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -61.62 -28.79 69.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.456 -0.777 . . . . 0.0 109.789 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -74.52 -1.25 20.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.158 -0.964 . . . . 0.0 109.262 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.8 mt -100.87 119.35 38.55 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.461 -0.775 . . . . 0.0 108.999 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.1 p-10 -74.11 -36.77 64.25 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.234 -0.917 . . . . 0.0 111.417 -179.027 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -72.15 19.18 0.07 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.703 -1.248 . . . . 0.0 110.978 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.8 mt -136.72 129.59 30.79 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.205 179.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 87.6 m -88.51 133.37 34.17 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 108.778 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -125.72 132.81 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.527 -0.733 . . . . 0.0 109.608 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.548 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 3.3 pt20 -153.62 154.52 34.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -104.41 118.01 35.56 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.357 -0.839 . . . . 0.0 108.822 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 15.3 m -87.62 152.31 22.27 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.71 134.21 36.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.384 -0.822 . . . . 0.0 109.613 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.726 ' C ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -150.72 93.57 1.97 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.006 -1.059 . . . . 0.0 109.185 -179.667 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.54 -141.67 41.5 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.9 t -87.0 -7.7 57.9 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.29 -1.123 . . . . 0.0 109.895 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -106.34 127.88 53.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.404 -0.81 . . . . 0.0 109.742 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.7 mt -75.15 133.53 41.47 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.401 ' CD2' ' OD1' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -106.89 120.37 41.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -74.98 146.36 41.73 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.498 -0.751 . . . . 0.0 109.271 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.03 150.24 41.04 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.365 -0.834 . . . . 0.0 108.927 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.0 pt -140.0 157.22 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 121.467 0.651 . . . . 0.0 109.408 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -149.02 147.93 29.13 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 110.94 16.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.018 -1.051 . . . . 0.0 109.247 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.57 -0.706 . . . . 0.0 109.848 -179.429 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 . . . . . 0 N--CA 1.495 1.815 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -45.45 158.03 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.514 0 C-N-CA 121.62 1.546 . . . . 0.0 112.21 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.9 mp -62.09 -40.39 95.67 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -54.39 -41.52 69.33 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.25 -0.906 . . . . 0.0 109.294 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -63.32 -42.91 99.02 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.317 -0.864 . . . . 0.0 109.264 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.8 ttt -62.04 -52.21 64.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.009 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -69.14 -42.13 76.38 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.03 -1.043 . . . . 0.0 110.038 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.8 m -62.05 -45.66 92.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.217 -0.927 . . . . 0.0 109.844 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.5 m -60.74 -42.38 97.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 109.7 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.38 95.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 110.354 -179.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 21' ' ' ALA . 96.5 mt -61.93 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.887 -1.133 . . . . 0.0 109.474 -179.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.73 -34.92 78.91 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.198 -0.939 . . . . 0.0 109.565 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.69 -28.59 68.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.102 -0.998 . . . . 0.0 110.08 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 m -136.73 27.93 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.47 -0.769 . . . . 0.0 109.715 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -62.88 -23.26 67.25 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.839 -1.163 . . . . 0.0 109.025 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 55.52 -168.98 0.08 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.247 0.546 . . . . 0.0 110.378 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -58.92 -48.19 82.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.228 -0.92 . . . . 0.0 110.565 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 m -71.65 151.29 43.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.912 -1.117 . . . . 0.0 109.359 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.01 -0.9 66.42 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -100.27 147.66 25.52 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.64 -0.917 . . . . 0.0 109.508 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.0 126.43 39.53 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.481 ' HG3' ' H ' ' A' ' 31' ' ' ALA . 12.8 pt-20 -63.44 138.89 58.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.235 -0.916 . . . . 0.0 109.638 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.597 HD23 ' OG ' ' A' ' 76' ' ' SER . 0.1 OUTLIER -54.31 -38.42 65.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.455 -0.778 . . . . 0.0 109.241 -178.74 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.6 m -55.91 -44.46 78.27 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 109.628 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.481 ' H ' ' HG3' ' A' ' 28' ' ' GLU . . . -66.38 -38.95 88.69 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.136 -0.978 . . . . 0.0 109.552 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.8 -50.2 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.001 -1.062 . . . . 0.0 109.369 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.09 97.99 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -59.8 -44.21 94.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.179 -1.189 . . . . 0.0 109.493 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -60.97 -47.69 85.29 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.77 -39.67 94.82 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.388 -0.82 . . . . 0.0 109.021 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.7 -45.52 81.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.14 -0.975 . . . . 0.0 109.591 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.1 -48.54 81.29 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.233 -0.917 . . . . 0.0 109.345 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -65.96 -40.19 91.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.309 -0.87 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.03 151.08 75.69 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.223 -0.923 . . . . 0.0 109.185 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -62.3 -35.04 75.87 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.697 1.598 . . . . 0.0 111.57 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.6 m -171.58 80.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.747 -0.596 . . . . 0.0 109.394 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -88.37 -76.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 63.19 91.13 0.08 OUTLIER Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -62.48 -17.55 58.59 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.374 1.383 . . . . 0.0 111.375 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -56.89 -47.46 80.43 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.364 -0.835 . . . . 0.0 109.026 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' A' ' 49' ' ' GLY . 98.1 m-20 -62.12 -33.8 75.14 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 27.1 m95 -75.96 26.55 0.12 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.176 -0.953 . . . . 0.0 109.783 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 51' ' ' GLY . . . 69.45 95.82 0.05 OUTLIER Glycine 0 N--CA 1.492 2.429 0 C-N-CA 119.964 -1.112 . . . . 0.0 110.371 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 49.27 -90.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.41 -1.053 . . . . 0.0 110.457 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 49' ' ' GLY . . . -157.76 62.9 0.32 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -58.7 -5.7 0.62 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.405 -1.056 . . . . 0.0 109.053 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 53' ' ' LEU . 8.9 mp -62.59 -39.48 93.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.3 p -55.89 -33.27 64.46 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.527 -0.733 . . . . 0.0 109.795 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -85.54 -33.58 21.72 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 28.2 ttt -66.03 -43.79 86.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.098 -1.001 . . . . 0.0 109.816 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.62 -22.36 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.187 -0.945 . . . . 0.0 109.81 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -62.55 -21.91 65.93 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.489 -0.757 . . . . 0.0 109.202 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -86.21 6.64 28.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.284 -0.885 . . . . 0.0 109.79 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' PHE . 95.4 mt -93.59 -11.64 31.32 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.11 -0.993 . . . . 0.0 109.41 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 63' ' ' LEU . 22.9 t0 61.3 -61.56 0.09 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.804 -0.56 . . . . 0.0 111.778 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.497 ' N ' ' O ' ' A' ' 60' ' ' LEU . 49.2 p90 -65.82 22.03 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.66 -1.275 . . . . 0.0 112.138 -178.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 61' ' ' ASP . 7.6 mt -136.59 133.27 36.15 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.261 -0.899 . . . . 0.0 109.181 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.6 m -88.11 138.1 31.75 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.1 t -123.65 132.71 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -131.4 132.24 44.23 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -120.58 123.14 42.13 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -109.95 134.2 52.36 Favored 'General case' 0 N--CA 1.507 2.395 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.512 ' HG2' ' NH1' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -72.78 132.61 43.82 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.706 -1.246 . . . . 0.0 108.512 -179.121 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -148.85 91.24 1.84 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.186 -0.946 . . . . 0.0 109.041 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.02 -135.99 28.44 Favored Glycine 0 N--CA 1.489 2.188 0 N-CA-C 109.734 -1.347 . . . . 0.0 109.734 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 87.4 p -86.56 -4.36 59.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.32 -1.106 . . . . 0.0 110.355 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -132.05 136.02 46.92 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.369 -0.832 . . . . 0.0 108.972 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -88.46 158.39 18.37 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 179.74 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -98.07 103.98 15.97 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.121 -0.987 . . . . 0.0 108.691 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.597 ' OG ' HD23 ' A' ' 29' ' ' LEU . 9.2 t -76.92 150.73 35.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 109.226 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -148.1 137.65 22.3 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.063 -1.023 . . . . 0.0 108.545 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 38.3 pt -117.86 145.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 CA-C-O 121.582 0.706 . . . . 0.0 109.728 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -159.02 142.22 14.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.291 -0.88 . . . . 0.0 108.63 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.21 137.01 52.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 108.91 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.609 -0.682 . . . . 0.0 110.119 -179.604 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -43.81 152.74 0.32 Allowed 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.804 1.669 . . . . 0.0 112.299 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.9 -40.99 99.26 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.432 -0.793 . . . . 0.0 109.231 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.8 -50.01 75.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -67.68 -30.85 70.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.869 . . . . 0.0 109.69 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 ttt -64.17 -63.97 1.01 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -63.06 -43.13 99.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.142 -0.974 . . . . 0.0 110.071 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.29 -45.87 91.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.4 m -61.93 -44.24 97.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.164 -0.96 . . . . 0.0 110.237 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.5 -46.2 60.37 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.999 -1.063 . . . . 0.0 110.857 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.48 -46.09 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.101 -0.999 . . . . 0.0 109.921 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -67.79 -36.17 79.95 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.362 -0.836 . . . . 0.0 109.671 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.56 93.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.125 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 m -99.55 -0.52 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.305 -0.872 . . . . 0.0 109.952 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.33 -47.17 86.43 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.031 -1.043 . . . . 0.0 108.613 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.413 ' C ' ' H ' ' A' ' 24' ' ' SER . 36.9 mtt180 48.57 34.81 5.28 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.761 0.791 . . . . 0.0 109.987 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 53.48 10.06 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.844 -0.535 . . . . 0.0 109.94 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 22' ' ' ARG . 85.9 p -79.36 165.77 22.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.27 -0.894 . . . . 0.0 109.602 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -56.52 110.33 2.02 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 38.3 m95 46.33 -163.56 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.569 -0.959 . . . . 0.0 110.424 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.82 133.79 40.16 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.53 -0.731 . . . . 0.0 109.179 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -69.15 133.86 48.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.914 . . . . 0.0 109.647 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 36.0 tp -58.38 -39.75 80.46 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.235 -0.916 . . . . 0.0 109.045 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -56.78 -41.3 77.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.254 -0.904 . . . . 0.0 109.257 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.68 88.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.264 -0.898 . . . . 0.0 109.576 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.3 -48.23 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.276 -0.89 . . . . 0.0 109.57 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.71 -46.85 93.37 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.3 m -62.76 -43.26 99.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.19 -1.183 . . . . 0.0 109.877 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.605 ' CE1' ' ND2' ' A' ' 39' ' ' ASN . 58.5 t80 -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 109.655 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.0 mt -63.03 -41.1 99.44 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.294 -0.879 . . . . 0.0 109.168 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.43 -42.67 74.51 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.103 -0.998 . . . . 0.0 109.246 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.93 -42.86 94.31 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.337 -0.852 . . . . 0.0 109.386 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.605 ' ND2' ' CE1' ' A' ' 35' ' ' TYR . 86.1 m-20 -88.9 6.5 38.95 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.325 -0.859 . . . . 0.0 109.492 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 36' ' ' LEU . 39.6 t0 -144.94 79.44 11.98 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.36 -0.837 . . . . 0.0 108.8 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -60.57 156.32 42.77 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.197 1.931 . . . . 0.0 111.865 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 p 70.43 -2.98 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.509 -0.744 . . . . 0.0 109.384 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -83.0 134.72 35.04 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.102 -0.999 . . . . 0.0 109.201 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.97 88.32 44.57 Favored Pre-proline 0 N--CA 1.502 2.129 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -54.24 -35.16 82.28 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 121.856 1.704 . . . . 0.0 110.633 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 47.7 mmm-85 -60.19 -36.93 78.74 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.071 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 49' ' ' GLY . 83.4 m-20 -63.3 -37.16 86.16 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.114 -0.991 . . . . 0.0 108.697 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -76.89 19.17 0.3 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.568 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 88.11 156.19 30.24 Favored Glycine 0 N--CA 1.501 2.97 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ARG . 58.6 t-80 -78.48 111.64 14.72 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.316 -1.108 . . . . 0.0 109.703 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 57.35 6.1 2.02 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' HIS . 40.2 ttp180 -65.46 -1.02 2.2 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.288 -1.125 . . . . 0.0 109.145 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.475 ' N ' HD12 ' A' ' 53' ' ' LEU . 10.3 mp -62.66 -38.67 91.22 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.7 p -55.24 -33.08 62.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -80.1 -35.96 36.1 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.049 -1.032 . . . . 0.0 109.379 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 tpt -65.42 -45.63 83.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.067 -1.02 . . . . 0.0 109.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.38 -23.86 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.066 -1.021 . . . . 0.0 109.662 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -67.43 -21.69 65.55 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.525 -0.734 . . . . 0.0 109.856 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -91.75 -8.22 47.46 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.072 -1.018 . . . . 0.0 110.543 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mt -94.19 -7.21 42.86 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.986 -1.071 . . . . 0.0 108.197 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 46.86 55.15 8.21 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.742 -0.598 . . . . 0.0 110.931 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -151.51 9.28 0.54 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.892 -1.13 . . . . 0.0 110.575 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mt -137.84 149.03 45.97 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 71.7 m -86.72 122.92 31.3 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.4 t -111.51 118.72 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -144.25 142.63 30.59 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -94.43 152.43 18.61 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.35 -0.844 . . . . 0.0 109.394 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 131.11 21.64 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -73.35 130.49 40.28 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -152.46 155.04 36.72 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 109.618 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.15 -131.18 51.92 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.1 m -113.76 8.68 17.51 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.843 -0.798 . . . . 0.0 109.588 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -147.57 153.56 39.59 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.995 . . . . 0.0 110.061 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.6 tp -63.43 136.95 57.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.486 -0.759 . . . . 0.0 109.237 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -121.88 134.55 54.87 Favored 'General case' 0 N--CA 1.505 2.299 0 CA-C-O 121.644 0.735 . . . . 0.0 109.231 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.4 p -77.86 158.01 29.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.523 -0.736 . . . . 0.0 109.28 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -144.9 144.59 31.17 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 pt -133.07 151.51 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.723 -0.611 . . . . 0.0 109.448 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -155.32 150.54 26.94 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.547 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -64.01 131.64 48.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.896 . . . . 0.0 108.609 -179.545 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.547 ' N ' HD13 ' A' ' 80' ' ' LEU . 12.0 ptp180 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.02 -1.05 . . . . 0.0 109.941 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -54.68 146.41 54.72 Favored 'Trans proline' 0 N--CA 1.499 1.811 0 C-N-CA 121.731 1.62 . . . . 0.0 112.135 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.23 -41.89 98.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.281 -0.887 . . . . 0.0 108.979 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -59.57 -39.84 85.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 0.0 109.088 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.17 -37.14 86.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.12 -0.988 . . . . 0.0 108.698 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 93.5 mtp -61.22 -48.01 83.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 109.841 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -68.97 -42.02 77.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.228 -0.92 . . . . 0.0 109.913 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 m -62.55 -50.11 72.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.015 -1.053 . . . . 0.0 110.009 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -66.37 -42.62 87.73 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.326 -0.859 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.1 65.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.154 -0.966 . . . . 0.0 111.526 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 93.0 mt -62.88 -44.61 99.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.838 -1.164 . . . . 0.0 109.584 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -66.37 -30.21 70.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.159 -0.963 . . . . 0.0 109.481 -179.897 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -48.48 75.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.132 -0.98 . . . . 0.0 110.721 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.46 18.01 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 121.352 -0.843 . . . . 0.0 109.841 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.507 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -60.45 -38.58 84.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 109.441 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 22' ' ' ARG . 32.6 mtm180 51.0 72.06 0.39 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 110.773 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 51.78 36.8 18.75 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.429 -0.794 . . . . 0.0 110.203 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.507 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 46.5 m -162.51 121.26 2.2 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.077 -1.014 . . . . 0.0 108.836 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.37 0.68 3.56 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.424 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.3 m95 -99.7 145.93 27.08 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.505 -0.997 . . . . 0.0 108.95 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.01 143.85 31.39 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 35.3 mp0 -68.72 132.39 46.75 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.003 -1.061 . . . . 0.0 109.369 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -55.09 -40.62 70.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.117 -0.989 . . . . 0.0 109.287 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -58.51 -43.76 89.24 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.249 -0.907 . . . . 0.0 108.909 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.03 -37.62 88.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.347 -0.845 . . . . 0.0 109.799 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.0 t -62.05 -49.5 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.11 -43.92 98.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.994 -1.243 . . . . 0.0 109.994 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.1 t -62.69 -45.18 93.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.001 -1.293 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 86.8 t80 -60.96 -48.48 81.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 109.499 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.71 -39.29 93.4 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.426 -0.796 . . . . 0.0 109.112 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.51 82.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.314 -0.866 . . . . 0.0 109.03 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.51 -44.15 91.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.639 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.8 m-80 -64.58 -40.33 95.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.279 -0.888 . . . . 0.0 110.371 -179.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.84 153.21 42.1 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.194 -0.941 . . . . 0.0 109.422 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -47.69 -43.72 27.87 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.19 1.26 . . . . 0.0 111.73 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.2 m -168.97 77.71 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.517 ' CG ' ' N ' ' A' ' 44' ' ' ASP . 45.6 t80 -60.03 -176.19 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.172 -0.955 . . . . 0.0 109.582 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.517 ' N ' ' CG ' ' A' ' 43' ' ' PHE . 3.6 m-20 -145.72 87.97 6.67 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -80.71 -92.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 121.646 1.564 . . . . 0.0 111.245 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.445 ' C ' ' H ' ' A' ' 48' ' ' TRP . 10.3 ptm180 -66.9 -22.3 65.97 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.005 -1.059 . . . . 0.0 109.898 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -51.14 -10.34 0.08 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.072 -1.017 . . . . 0.0 109.795 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.508 ' CD1' ' O ' ' A' ' 44' ' ' ASP . 10.1 m0 -76.59 -25.96 54.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.188 -0.945 . . . . 0.0 108.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 168.06 -168.17 40.62 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -74.45 76.79 1.92 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.391 -1.064 . . . . 0.0 109.787 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.03 17.98 79.18 Favored Glycine 0 N--CA 1.498 2.831 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.493 ' HG2' HH11 ' A' ' 52' ' ' ARG . 75.8 ttt-85 -62.51 -19.03 63.19 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.267 -1.137 . . . . 0.0 108.935 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.32 -44.14 97.18 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -63.03 -35.03 78.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.543 -0.723 . . . . 0.0 109.213 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -77.5 -29.19 52.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.31 -0.868 . . . . 0.0 109.5 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.3 ttp -62.9 -46.4 88.02 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.284 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.67 -30.07 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.196 -0.94 . . . . 0.0 109.554 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.3 -35.95 78.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.187 -0.946 . . . . 0.0 109.8 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -64.34 -35.43 80.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 108.874 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -75.48 138.87 41.88 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.672 -0.642 . . . . 0.0 109.281 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -87.57 -32.72 19.2 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.408 -0.808 . . . . 0.0 111.324 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -76.29 18.0 0.33 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.911 -1.118 . . . . 0.0 110.764 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.35 127.82 32.44 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.465 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 86.0 m -92.08 135.39 34.01 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.2 t -109.88 130.94 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.483 -0.76 . . . . 0.0 109.146 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -153.4 157.12 39.48 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 67' ' ' GLU . 2.0 pm0 -145.86 155.81 43.13 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.051 -1.031 . . . . 0.0 108.558 -179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 66.1 m -132.4 147.62 52.39 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.685 HH11 ' HG3' ' A' ' 69' ' ' ARG . 9.0 mtm-85 -76.52 140.91 41.34 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.394 0.616 . . . . 0.0 109.79 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -150.94 100.71 2.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.442 -0.786 . . . . 0.0 109.684 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 64.61 -139.09 40.89 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.3 p -89.29 4.62 48.21 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.398 -1.06 . . . . 0.0 109.868 -179.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -139.38 114.64 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.468 -0.77 . . . . 0.0 109.542 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -76.06 141.29 42.09 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -102.92 123.07 45.85 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.545 -0.722 . . . . 0.0 109.434 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.8 m -71.18 149.8 45.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.472 -0.768 . . . . 0.0 109.057 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -139.64 153.42 47.31 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 pt -141.39 156.45 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt-85 -137.84 147.96 45.0 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.26 117.9 29.35 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.465 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 92.6 mtt-85 . . . . . 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 110.184 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.539 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.048 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 22.1 Cg_exo -62.45 143.39 93.24 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 122.144 1.896 . . . . 0.0 112.145 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -65.26 -42.02 93.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.383 -0.823 . . . . 0.0 109.233 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.28 -43.75 97.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 109.607 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.26 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' HD22 ' A' ' 36' ' ' LEU . 39.8 tpp -61.58 -53.84 51.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.294 -0.879 . . . . 0.0 109.814 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -70.16 -40.66 74.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.193 -0.942 . . . . 0.0 109.999 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -62.63 -45.55 92.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.068 -1.02 . . . . 0.0 109.661 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -60.17 -45.03 94.46 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.202 -0.936 . . . . 0.0 110.07 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.46 -48.06 43.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.232 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.57 -44.61 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.126 -0.983 . . . . 0.0 109.475 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -66.27 -33.51 75.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.209 -0.932 . . . . 0.0 109.889 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.38 -59.15 3.63 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.182 -0.949 . . . . 0.0 110.706 -179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -96.72 29.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.345 -0.847 . . . . 0.0 109.918 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.75 -20.49 2.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.974 -1.079 . . . . 0.0 109.97 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.639 ' HG3' HH11 ' A' ' 22' ' ' ARG . 3.7 ttt85 60.21 43.4 13.98 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.594 -0.691 . . . . 0.0 109.24 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 41.58 37.49 0.72 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.782 -0.574 . . . . 0.0 111.192 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.6 p -143.82 9.32 1.53 Allowed 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.173 -0.954 . . . . 0.0 109.39 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.87 -43.73 0.98 Allowed Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.437 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 99.4 m95 -75.17 174.87 8.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.3 -1.117 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.35 145.43 22.75 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -71.28 127.44 32.56 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.468 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.03 -42.21 68.89 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.125 -0.984 . . . . 0.0 109.512 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -60.13 -43.29 95.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.227 -0.921 . . . . 0.0 109.069 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.02 81.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.75 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.79 -49.04 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.965 -1.084 . . . . 0.0 109.6 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.66 -49.56 77.3 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.3 m -64.98 -42.22 94.74 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.288 -1.125 . . . . 0.0 110.017 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -60.56 -49.3 78.08 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.258 -0.901 . . . . 0.0 109.558 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.486 ' O ' ' N ' ' A' ' 40' ' ' ASP . 91.6 mt -63.1 -41.95 99.48 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.299 -0.876 . . . . 0.0 109.029 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.62 86.88 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.885 . . . . 0.0 109.288 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.5 -42.89 95.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.435 -0.79 . . . . 0.0 109.678 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -85.14 -2.93 58.58 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.226 -0.921 . . . . 0.0 109.531 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 36' ' ' LEU . 23.9 t70 -161.14 75.79 2.5 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.83 -27.34 52.53 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.141 1.894 . . . . 0.0 111.071 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 m -66.37 -8.21 24.08 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.566 -0.709 . . . . 0.0 109.397 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -69.31 134.23 48.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.352 -0.842 . . . . 0.0 109.254 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -117.85 91.04 38.16 Favored Pre-proline 0 N--CA 1.504 2.239 0 O-C-N 121.815 -0.553 . . . . 0.0 109.85 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.04 -17.34 30.85 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.148 1.899 . . . . 0.0 111.021 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 46' ' ' ARG . 78.4 mtt180 -63.98 -35.63 81.32 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.613 0.72 . . . . 0.0 109.229 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -61.36 -36.1 79.26 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CD1' ' N ' ' A' ' 48' ' ' TRP . 48.4 m95 -77.99 3.59 14.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 50' ' ' HIS . . . 70.36 -1.71 18.58 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' ARG . 72.9 t60 59.1 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.822 -0.81 . . . . 0.0 109.923 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.505 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 68.91 -65.24 0.48 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.536 ' HG3' HH11 ' A' ' 52' ' ' ARG . 85.2 mtm-85 -59.58 2.45 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.68 -0.894 . . . . 0.0 109.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 51' ' ' GLY . 59.1 tp -57.77 -41.04 81.18 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.984 -1.073 . . . . 0.0 108.511 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -60.93 -41.97 97.25 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 108.946 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.9 mm-40 -71.52 -30.22 65.68 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.874 -1.141 . . . . 0.0 109.796 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.9 mmm -63.17 -42.99 99.49 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.873 -1.142 . . . . 0.0 109.544 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.0 m -73.55 -22.92 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.089 -1.007 . . . . 0.0 109.734 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -61.92 -39.08 90.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.046 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -98.2 56.77 1.21 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.371 -0.83 . . . . 0.0 110.003 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 mt -146.14 -6.32 0.57 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.508 ' O ' ' N ' ' A' ' 63' ' ' LEU . 23.0 t70 62.68 -174.15 0.15 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.344 -0.847 . . . . 0.0 110.134 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.488 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 31.1 p90 40.72 20.05 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.592 0 CA-C-O 121.295 0.569 . . . . 0.0 110.904 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.3 mt -141.97 131.63 24.07 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.214 -0.929 . . . . 0.0 109.472 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 81' ' ' ARG . 98.5 m -101.37 134.57 44.25 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.78 131.95 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 O-C-N 121.671 -0.643 . . . . 0.0 109.439 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.437 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 88.8 mt-30 -137.65 149.62 46.73 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -140.21 136.23 33.19 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.0 p -132.88 152.46 51.86 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.54 ' HG2' ' NH1' ' A' ' 69' ' ' ARG . 2.8 mtt-85 -89.11 130.66 35.52 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 75' ' ' HIS . 14.4 p-10 -150.31 114.45 5.11 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.019 -1.051 . . . . 0.0 109.619 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.4 -137.16 34.84 Favored Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.3 p -93.47 -0.95 56.21 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.314 -1.109 . . . . 0.0 110.248 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 68.5 mttm -134.81 139.35 45.03 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.376 -0.828 . . . . 0.0 109.684 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.65 151.08 37.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.232 -0.918 . . . . 0.0 109.077 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.47 ' CG ' ' OE2' ' A' ' 77' ' ' GLU . 19.5 t-160 -100.25 100.9 11.78 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.7 p -83.92 151.91 24.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.432 -0.793 . . . . 0.0 108.901 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.472 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 53.9 mp0 -146.44 153.59 40.63 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 pt -133.16 150.82 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 CA-C-O 121.398 0.618 . . . . 0.0 109.746 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -151.72 154.17 35.79 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 81' ' ' ARG . 60.4 mt -64.03 153.29 37.82 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.579 -0.701 . . . . 0.0 109.401 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 80' ' ' LEU . 9.0 tpp180 . . . . . 0 N--CA 1.509 2.512 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m80 . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -46.06 139.03 12.06 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.713 1.608 . . . . 0.0 112.221 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.488 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.2 mp -63.08 -41.6 99.45 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.326 -0.859 . . . . 0.0 108.798 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -57.96 -38.51 76.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 109.153 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -63.09 -42.13 99.55 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.17 -0.956 . . . . 0.0 109.451 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.5 mmm -63.5 -47.41 81.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.677 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -72.65 -43.86 62.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.094 -1.003 . . . . 0.0 110.163 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.54 -50.14 72.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.122 -0.986 . . . . 0.0 110.331 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.3 m -64.84 -42.33 94.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.37 -0.831 . . . . 0.0 110.254 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.18 48.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.54 -44.29 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 109.861 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -65.43 -33.82 76.84 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.73 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -39.43 93.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.012 . . . . 0.0 110.027 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.29 16.91 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.448 -0.782 . . . . 0.0 110.038 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.1 11.41 9.78 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.966 -1.084 . . . . 0.0 108.774 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HD3' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -46.71 143.53 2.72 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.382 -0.823 . . . . 0.0 110.7 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 t0 56.05 24.66 8.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.848 -0.533 . . . . 0.0 110.169 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.0 m 51.65 -153.53 0.19 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.976 -1.078 . . . . 0.0 109.921 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.82 56.57 4.07 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.491 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 36.6 m95 42.57 -139.48 0.18 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.779 -0.836 . . . . 0.0 110.624 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.71 138.52 11.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.022 -1.048 . . . . 0.0 108.692 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.87 125.37 28.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.127 -0.983 . . . . 0.0 109.286 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -54.29 -39.27 66.79 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.346 -0.846 . . . . 0.0 109.104 -178.201 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.1 t -59.94 -43.94 94.68 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.777 -1.202 . . . . 0.0 108.885 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.29 -40.7 94.17 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.0 t -63.47 -51.0 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.132 -0.98 . . . . 0.0 109.678 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.67 -41.85 99.77 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.21 -44.43 96.59 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.15 -1.206 . . . . 0.0 109.694 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.559 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 76.9 t80 -57.45 -43.34 83.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 109.353 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.0 mt -63.29 -38.16 90.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.916 . . . . 0.0 108.93 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.69 -46.69 70.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.009 -1.057 . . . . 0.0 109.708 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -63.37 -40.17 96.52 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.081 -1.012 . . . . 0.0 109.174 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.559 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 80.1 m-20 -90.46 7.2 40.02 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.074 -1.016 . . . . 0.0 109.297 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.2 t0 -164.71 57.83 0.56 Allowed Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 108.884 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 43' ' ' PHE . 27.7 Cg_endo -60.9 174.09 1.93 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 122.091 1.86 . . . . 0.0 111.947 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 m 66.36 -6.61 0.48 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' A' ' 41' ' ' PRO . 47.8 t80 -94.41 -74.44 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.093 -1.004 . . . . 0.0 108.665 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.1 t0 63.91 91.51 0.08 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.432 ' O ' ' N ' ' A' ' 49' ' ' GLY . 51.2 Cg_exo -54.02 -38.32 86.78 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.84 1.694 . . . . 0.0 111.653 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -55.43 -39.11 69.86 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.602 -0.686 . . . . 0.0 109.916 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -49.8 -44.25 49.01 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.924 -1.11 . . . . 0.0 110.454 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.456 ' NE1' ' CZ ' ' A' ' 43' ' ' PHE . 49.0 p-90 -116.22 16.25 15.88 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.521 -0.737 . . . . 0.0 109.222 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -161.38 62.53 0.28 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.485 ' C ' ' H ' ' A' ' 52' ' ' ARG . 49.9 t-80 -69.27 98.9 1.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.515 -0.991 . . . . 0.0 109.1 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.84 -38.92 0.24 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.049 -1.221 . . . . 0.0 110.049 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 50' ' ' HIS . 83.6 mtm-85 -66.9 -1.62 4.22 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -1.178 . . . . 0.0 109.442 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.32 -42.18 99.16 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.9 p -62.05 -27.48 68.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.24 -0.912 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -81.87 -34.88 29.84 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -62.44 -41.07 98.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.248 -0.908 . . . . 0.0 109.53 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.83 -9.07 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.384 -0.822 . . . . 0.0 109.766 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -58.75 -30.76 67.75 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.158 -0.963 . . . . 0.0 109.698 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.22 -7.63 48.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.068 -1.02 . . . . 0.0 108.984 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.9 mt -93.82 110.63 22.27 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.96 -1.088 . . . . 0.0 108.891 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.445 ' C ' ' H ' ' A' ' 63' ' ' LEU . 67.1 t0 -65.09 -37.84 88.82 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.345 -0.847 . . . . 0.0 111.133 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -70.98 20.18 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.772 -1.205 . . . . 0.0 111.262 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 61' ' ' ASP . 10.5 mt -138.07 125.64 22.12 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.222 -0.924 . . . . 0.0 108.839 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 84.0 m -87.8 142.44 27.81 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.397 -0.814 . . . . 0.0 108.883 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.6 t -117.17 129.53 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.491 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 49.3 tt0 -155.9 155.93 33.72 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 67' ' ' GLU . 1.8 pm0 -144.94 146.42 31.97 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.117 -0.989 . . . . 0.0 110.199 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.1 m -167.23 152.39 7.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.311 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.53 170.63 4.08 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.59 167.77 17.8 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 122.198 0.999 . . . . 0.0 111.056 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.69 -150.3 42.47 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.9 p -96.44 6.92 47.75 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.47 -1.018 . . . . 0.0 109.271 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -87.77 150.62 23.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.079 -1.013 . . . . 0.0 109.504 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -123.86 122.9 39.21 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -91.13 137.19 32.56 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.327 -0.858 . . . . 0.0 108.907 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 m -71.21 140.89 50.62 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.811 -1.181 . . . . 0.0 109.13 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -149.87 136.43 19.17 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.271 -0.893 . . . . 0.0 109.144 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 O-C-N 121.339 -0.851 . . . . 0.0 109.8 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -144.32 145.95 32.3 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.532 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -74.17 138.66 43.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.28 -0.887 . . . . 0.0 108.947 -179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.532 ' H ' HD13 ' A' ' 80' ' ' LEU . 12.7 tpt180 . . . . . 0 C--N 1.301 -1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.756 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.52 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.179 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 16.2 Cg_exo -66.13 140.73 60.62 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.346 2.03 . . . . 0.0 111.928 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.511 ' N ' HD12 ' A' ' 9' ' ' LEU . 9.9 mp -64.79 -43.59 92.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.148 -0.97 . . . . 0.0 109.346 179.511 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -63.48 -46.86 84.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.124 -0.985 . . . . 0.0 110.056 -179.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.82 -34.87 79.15 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.163 -0.96 . . . . 0.0 109.608 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.7 ttt -60.9 -51.98 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.142 -0.974 . . . . 0.0 109.982 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -69.7 -39.73 76.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.999 -1.063 . . . . 0.0 109.748 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.8 m -60.4 -45.24 94.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.025 -1.047 . . . . 0.0 109.641 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.3 p -61.94 -42.95 99.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.212 -0.93 . . . . 0.0 110.12 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.85 -46.05 55.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.061 -1.024 . . . . 0.0 110.843 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.49 -46.6 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.046 -1.034 . . . . 0.0 109.723 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -67.83 -34.19 76.24 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 109.843 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.84 92.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.334 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -100.46 5.74 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.317 -0.865 . . . . 0.0 109.702 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -67.14 -7.7 25.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.013 -1.054 . . . . 0.0 108.877 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -61.91 81.38 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.218 -0.926 . . . . 0.0 109.933 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 21' ' ' ALA . 34.7 t70 -173.54 -50.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.0 t -168.87 -30.69 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.772 . . . . 0.0 109.505 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.38 -64.08 0.33 Allowed Glycine 0 N--CA 1.498 2.809 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -54.28 -174.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -1.137 . . . . 0.0 110.166 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.3 136.64 14.03 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.375 -0.828 . . . . 0.0 108.86 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 56.5 mp0 -73.78 132.03 42.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.286 -0.884 . . . . 0.0 109.684 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.24 -40.81 74.73 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.329 -0.857 . . . . 0.0 109.172 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -57.09 -42.92 81.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.036 -1.04 . . . . 0.0 109.111 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.32 90.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 92.9 t -63.13 -48.84 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 109.542 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.73 97.32 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -68.39 -42.01 79.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -1.179 . . . . 0.0 109.892 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 67.7 t80 -61.64 -47.9 83.31 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.152 -0.967 . . . . 0.0 109.57 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.08 -40.82 98.8 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.236 -0.915 . . . . 0.0 108.753 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.34 77.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.104 -0.998 . . . . 0.0 109.512 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -61.63 -46.43 89.85 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.992 -1.068 . . . . 0.0 109.371 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.537 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.7 m-80 -65.15 -39.29 92.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -0.922 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.45 82.99 44.57 Favored Pre-proline 0 N--CA 1.502 2.128 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.27 -29.69 68.45 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.382 2.055 . . . . 0.0 111.1 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 m -67.63 -7.91 30.38 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.544 -0.723 . . . . 0.0 109.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -88.96 123.07 32.96 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.383 -0.823 . . . . 0.0 108.785 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -124.93 82.26 61.29 Favored Pre-proline 0 N--CA 1.502 2.153 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.505 ' O ' ' N ' ' A' ' 49' ' ' GLY . 34.1 Cg_endo -75.59 -33.64 3.89 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 C-N-CA 121.579 1.519 . . . . 0.0 110.947 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.605 ' HG3' HH11 ' A' ' 46' ' ' ARG . 80.6 mtt85 -62.85 -43.61 98.34 Favored 'General case' 0 N--CA 1.492 1.656 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -48.22 -31.53 5.93 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -178.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.8 p-90 -133.42 24.81 4.12 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -169.87 55.9 0.2 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -60.32 -47.2 87.03 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.359 -1.083 . . . . 0.0 109.48 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.51 -29.57 0.42 Allowed Glycine 0 N--CA 1.504 3.193 0 N-CA-C 109.112 -1.595 . . . . 0.0 109.112 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -5.1 2.66 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.369 -1.077 . . . . 0.0 109.177 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.27 -39.47 93.01 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 0.0 108.796 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.4 t -59.22 -39.9 84.15 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.366 -0.834 . . . . 0.0 109.371 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -75.83 -26.85 57.57 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.089 -1.007 . . . . 0.0 109.886 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.4 mmt -64.73 -43.21 94.11 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.775 -1.203 . . . . 0.0 109.633 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.413 HG22 ' H ' ' A' ' 57' ' ' VAL . 15.9 m -69.99 -22.39 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.236 -0.915 . . . . 0.0 109.62 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -62.69 -30.8 71.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 109.355 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -63.22 -34.25 77.25 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.206 -0.934 . . . . 0.0 109.272 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.97 116.05 14.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.356 -0.84 . . . . 0.0 109.334 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.453 ' C ' ' H ' ' A' ' 63' ' ' LEU . 90.0 m-20 -64.57 -40.78 96.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.538 -0.726 . . . . 0.0 111.596 -178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -70.57 19.03 0.05 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.634 -1.291 . . . . 0.0 111.349 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.453 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.9 mt -136.39 122.25 19.97 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.33 -0.856 . . . . 0.0 109.05 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 97.5 m -91.55 137.65 32.2 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.63 128.23 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.617 -0.677 . . . . 0.0 109.835 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -145.06 146.42 31.85 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 55.4 mp0 -95.92 148.49 22.57 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -127.82 140.23 52.16 Favored 'General case' 0 N--CA 1.503 2.197 0 CA-C-O 121.677 0.751 . . . . 0.0 109.498 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.646 HH11 ' HG2' ' A' ' 69' ' ' ARG . 3.3 mmt-85 -77.01 131.54 38.51 Favored 'General case' 0 N--CA 1.497 1.897 0 CA-C-O 121.42 0.629 . . . . 0.0 109.796 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -149.01 101.51 3.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.537 -0.727 . . . . 0.0 110.298 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 59.03 -142.62 46.35 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.8 t -85.68 1.46 49.28 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -1.202 . . . . 0.0 110.15 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -139.04 117.11 11.73 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.359 -0.838 . . . . 0.0 109.564 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -73.97 174.1 9.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.508 -0.745 . . . . 0.0 109.033 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -144.24 137.67 27.47 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.206 -0.934 . . . . 0.0 109.574 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.2 t -70.22 150.41 46.46 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.488 -0.757 . . . . 0.0 109.402 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -134.94 150.81 50.44 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 pt -132.72 152.61 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -149.96 152.49 35.04 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.04 109.26 14.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.161 -0.962 . . . . 0.0 109.043 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.47 -0.769 . . . . 0.0 110.016 -179.584 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.001 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 144.62 98.91 Favored 'Trans proline' 0 N--CA 1.499 1.845 0 C-N-CA 121.854 1.703 . . . . 0.0 111.882 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.6 mt -63.99 -42.13 97.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.432 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -64.79 -45.91 84.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.882 . . . . 0.0 109.594 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -66.11 -27.16 67.84 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.271 -0.893 . . . . 0.0 109.15 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.474 ' SD ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -67.5 -63.73 1.0 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.474 -0.766 . . . . 0.0 110.309 -179.252 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -61.89 -45.81 92.11 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.213 -0.929 . . . . 0.0 110.542 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.3 p -59.81 -44.06 94.19 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.995 -1.066 . . . . 0.0 110.408 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 t -61.11 -46.07 92.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.914 -1.117 . . . . 0.0 110.145 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.97 -48.39 45.31 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.386 -0.822 . . . . 0.0 110.837 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.417 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 91.5 mt -61.57 -48.07 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.132 -0.98 . . . . 0.0 109.711 -178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -66.91 -25.12 66.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 109.546 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.94 -32.73 51.68 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.024 -1.048 . . . . 0.0 110.564 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ARG . 5.9 m -108.32 -0.41 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.959 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -71.82 16.08 0.13 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.915 -1.116 . . . . 0.0 109.081 179.317 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.8 mtp180 -48.77 -13.02 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.881 -1.137 . . . . 0.0 110.422 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 21' ' ' ALA . 25.6 p30 -74.22 -5.89 44.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.241 -0.912 . . . . 0.0 109.339 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p 68.8 40.45 1.73 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.475 -0.766 . . . . 0.0 109.194 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.74 -140.37 4.12 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -54.63 -170.33 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.902 . . . . 0.0 110.064 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.28 139.76 20.52 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.221 -0.924 . . . . 0.0 108.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -69.93 128.04 34.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 109.343 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.5 -39.27 83.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.427 -0.795 . . . . 0.0 109.186 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.0 m -55.68 -43.82 76.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.921 -1.112 . . . . 0.0 109.402 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.93 -37.88 89.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.319 -0.863 . . . . 0.0 109.205 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 75.7 t -62.92 -48.55 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.219 -0.925 . . . . 0.0 109.74 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.19 -44.93 97.03 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 t -62.98 -45.06 94.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.222 -1.164 . . . . 0.0 109.953 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.419 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.0 t80 -61.04 -48.77 80.21 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.985 -1.072 . . . . 0.0 109.438 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 40' ' ' ASP . 93.0 mt -65.01 -41.18 95.56 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.216 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.36 -45.69 80.36 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.871 -1.143 . . . . 0.0 109.631 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -64.65 -42.3 95.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -0.884 . . . . 0.0 110.095 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.419 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 89.5 m-20 -86.67 -4.56 59.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.08 -1.013 . . . . 0.0 109.689 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 36' ' ' LEU . 16.4 m-20 -154.48 63.76 4.22 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.428 ' C ' ' H ' ' A' ' 43' ' ' PHE . 13.6 Cg_endo -54.76 -166.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.739 1.626 . . . . 0.0 111.859 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t 69.36 -6.24 1.0 Allowed 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -178.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 41' ' ' PRO . 1.6 t80 -77.51 135.68 38.25 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.234 -0.916 . . . . 0.0 108.661 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -123.82 84.6 54.1 Favored Pre-proline 0 N--CA 1.503 2.218 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -62.56 -25.35 75.55 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 121.905 1.737 . . . . 0.0 110.649 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 48' ' ' TRP . 47.7 mmm-85 -66.57 -37.74 85.59 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.951 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -55.55 -7.6 0.28 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.444 -0.785 . . . . 0.0 110.052 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.416 ' H ' ' C ' ' A' ' 46' ' ' ARG . 65.3 m95 -97.27 -15.79 20.64 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.136 -0.977 . . . . 0.0 109.613 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 48' ' ' TRP . . . 49.76 101.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.643 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 82.1 t60 51.03 84.4 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.096 -1.237 . . . . 0.0 110.469 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 159.33 -57.36 0.33 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 45.4 mtm180 48.29 -133.19 1.39 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.487 -1.008 . . . . 0.0 110.225 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.497 ' N ' HD12 ' A' ' 53' ' ' LEU . 10.3 mp -63.78 -36.57 84.34 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -49.57 -31.2 9.97 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.554 -0.716 . . . . 0.0 109.377 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -82.69 -40.66 20.33 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 33.6 tpp -62.4 -46.99 86.09 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.191 -0.943 . . . . 0.0 109.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.6 m -64.64 -35.37 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.082 -1.011 . . . . 0.0 109.615 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -57.45 -42.64 82.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 -179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -67.24 -44.37 79.62 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.025 -1.047 . . . . 0.0 109.262 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.3 mt -75.56 143.26 42.51 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.444 -0.785 . . . . 0.0 109.94 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 63' ' ' LEU . 71.4 m-20 -92.85 -150.86 0.28 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.335 -0.853 . . . . 0.0 109.913 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 54.4 p90 42.45 19.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.527 -0.733 . . . . 0.0 111.17 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 61' ' ' ASP . 15.7 mt -132.52 130.07 39.93 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.567 -0.708 . . . . 0.0 109.543 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 88.7 m -89.38 134.63 33.99 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 53.3 t -120.19 130.55 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.317 0 O-C-N 121.553 -0.717 . . . . 0.0 109.109 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -151.25 118.73 6.04 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -124.25 135.73 53.62 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.661 0.743 . . . . 0.0 109.705 -178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.7 t -100.23 125.23 46.38 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 mtt180 -68.73 135.59 51.52 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.026 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -150.0 103.89 3.24 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.483 -0.761 . . . . 0.0 109.737 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.74 -142.49 43.56 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 33.3 t -84.74 -9.03 58.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.284 -1.127 . . . . 0.0 110.247 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -121.45 116.55 24.95 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -89.7 151.17 21.99 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.955 -1.09 . . . . 0.0 108.519 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -99.77 99.95 10.84 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.364 -0.835 . . . . 0.0 109.066 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.5 t -75.37 146.58 40.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.407 -0.808 . . . . 0.0 109.217 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -142.75 143.64 32.31 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.9 pt -133.63 155.65 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-O 121.48 0.657 . . . . 0.0 109.77 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt85 -150.23 150.73 31.97 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.502 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -72.53 121.62 19.97 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.502 ' N ' HD13 ' A' ' 80' ' ' LEU . 7.7 tpt180 . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.451 -0.78 . . . . 0.0 110.268 -178.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.534 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 1' ' ' MET . 37.9 Cg_endo -62.61 144.37 94.15 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.247 1.965 . . . . 0.0 111.715 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.52 ' O ' ' N ' ' A' ' 5' ' ' GLU . 80.8 m80 -101.68 133.41 46.44 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.605 -0.684 . . . . 0.0 109.24 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.519 ' O ' ' N ' ' A' ' 6' ' ' LYS . 64.4 mttp 54.23 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.885 -0.51 . . . . 0.0 110.218 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 3' ' ' HIS . 39.1 tp10 60.9 -72.44 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.686 -0.634 . . . . 0.0 109.71 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 4' ' ' LYS . 65.2 mttp 54.12 108.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.734 0.778 . . . . 0.0 110.709 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.54 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -66.9 -42.42 42.74 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.28 -0.887 . . . . 0.0 109.986 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 37.9 Cg_exo -60.69 126.68 20.41 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.05 1.834 . . . . 0.0 111.826 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.6 mp -65.32 -42.26 93.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.197 -0.94 . . . . 0.0 109.366 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -55.18 -53.05 60.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.285 -0.884 . . . . 0.0 110.151 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -67.06 -39.44 86.88 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.117 -0.989 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 49.1 ttp -61.09 -50.09 74.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.249 -0.907 . . . . 0.0 110.045 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -67.47 -38.32 84.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.974 -1.079 . . . . 0.0 109.316 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -46.52 89.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.052 -1.03 . . . . 0.0 109.788 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.4 m -62.38 -43.13 99.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 110.399 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.76 -43.1 84.97 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.022 -1.049 . . . . 0.0 110.613 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.95 -44.83 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 109.609 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -67.26 -34.07 76.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.36 -0.837 . . . . 0.0 109.763 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.57 94.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.354 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.88 7.19 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.317 -0.864 . . . . 0.0 110.183 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -7.11 15.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.928 -1.107 . . . . 0.0 109.695 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.717 HH11 ' HG2' ' A' ' 22' ' ' ARG . 12.1 mtp85 -71.2 -19.93 62.33 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.31 -0.869 . . . . 0.0 108.883 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -61.34 -50.96 70.83 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.206 -0.934 . . . . 0.0 109.481 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 26' ' ' TRP . 2.5 m -179.78 77.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.544 -0.722 . . . . 0.0 109.263 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.0 -91.14 0.02 OUTLIER Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' A' ' 24' ' ' SER . 70.2 m95 -54.7 -174.07 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.444 -1.033 . . . . 0.0 109.985 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.04 134.29 29.57 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.661 -0.649 . . . . 0.0 109.343 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.36 134.63 48.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.342 -0.849 . . . . 0.0 109.335 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.56 -40.58 75.41 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 109.405 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 t -59.34 -43.14 92.8 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.108 -0.995 . . . . 0.0 109.161 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.22 88.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.252 -0.905 . . . . 0.0 109.617 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.45 -46.95 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.242 -0.911 . . . . 0.0 109.363 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.15 81.74 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.9 m -62.45 -42.57 99.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.162 -1.199 . . . . 0.0 109.688 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.546 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 67.8 t80 -60.75 -48.6 81.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.857 . . . . 0.0 109.387 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.16 -39.08 93.26 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 108.984 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.37 -48.56 80.21 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.99 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -73.15 -51.2 18.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.106 -0.996 . . . . 0.0 110.411 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.546 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 68.8 m-80 -65.43 -39.97 92.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.265 -0.897 . . . . 0.0 109.808 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -123.86 84.66 54.21 Favored Pre-proline 0 N--CA 1.502 2.138 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.32 -28.46 62.76 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.997 1.798 . . . . 0.0 111.333 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.1 p -67.54 -11.83 58.93 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.492 -0.755 . . . . 0.0 109.618 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -75.73 122.63 24.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.12 -0.987 . . . . 0.0 109.122 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -119.58 90.12 42.31 Favored Pre-proline 0 N--CA 1.505 2.278 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -63.28 -20.35 70.34 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.811 1.674 . . . . 0.0 110.776 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -62.71 -38.89 92.25 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.31 -37.97 85.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.296 -0.878 . . . . 0.0 108.725 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.526 ' CD2' ' SD ' ' A' ' 56' ' ' MET . 97.4 m95 -83.95 9.78 11.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.241 -0.912 . . . . 0.0 109.336 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 69.17 151.46 0.45 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.41 ' C ' ' H ' ' A' ' 52' ' ' ARG . 86.7 t60 -79.15 147.69 32.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.354 -1.086 . . . . 0.0 109.549 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.13 -40.01 0.7 Allowed Glycine 0 N--CA 1.494 2.513 0 N-CA-C 110.222 -1.151 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' H ' ' C ' ' A' ' 50' ' ' HIS . 89.4 mtt180 -67.44 -4.89 12.52 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.125 -1.221 . . . . 0.0 108.933 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.66 -40.8 98.2 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -60.53 -42.81 97.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.333 -0.855 . . . . 0.0 109.282 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.406 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 21.8 mp0 -69.15 -27.12 65.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.86 . . . . 0.0 109.565 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.526 ' SD ' ' CD2' ' A' ' 48' ' ' TRP . 46.6 ttp -63.93 -48.73 75.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.932 -1.105 . . . . 0.0 109.481 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.8 m -69.16 -23.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.276 -0.89 . . . . 0.0 109.612 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.8 -28.62 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.485 -0.759 . . . . 0.0 109.378 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -77.49 -4.13 43.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.96 . . . . 0.0 109.567 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.92 109.82 22.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.352 -0.843 . . . . 0.0 108.984 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.449 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.4 m-20 -64.52 -39.37 93.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.495 -0.753 . . . . 0.0 111.192 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -70.29 19.29 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.851 -1.156 . . . . 0.0 111.288 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.449 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.7 mt -138.15 126.61 23.33 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.26 -0.9 . . . . 0.0 108.857 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 43.2 m -88.59 130.97 35.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.6 t -115.6 130.67 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 121.574 -0.704 . . . . 0.0 109.356 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -142.3 153.72 44.12 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.462 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.3 mp0 -107.46 119.11 38.51 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.4 m -85.49 155.86 21.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.216 -0.927 . . . . 0.0 108.511 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.83 83.17 4.75 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.543 ' ND2' ' CE1' ' A' ' 75' ' ' HIS . 52.6 t-20 -94.0 104.92 16.95 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.417 -0.802 . . . . 0.0 109.502 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.17 -142.09 44.92 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.62 -6.39 58.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.405 -1.056 . . . . 0.0 109.745 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -106.07 142.08 36.37 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.528 -0.732 . . . . 0.0 109.685 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.2 mt -91.6 123.39 34.97 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.543 ' CE1' ' ND2' ' A' ' 70' ' ' ASN . 48.2 m170 -101.9 135.63 43.12 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.605 -0.684 . . . . 0.0 109.299 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.1 m -79.24 148.48 32.19 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.412 -0.805 . . . . 0.0 109.133 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.6 mp0 -137.34 155.02 49.9 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.6 pt -134.48 153.6 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.734 -0.603 . . . . 0.0 109.386 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -143.58 148.77 36.4 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -85.76 120.46 27.21 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.743 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.492 ' N ' HD13 ' A' ' 80' ' ' LEU . 20.6 mmt85 -53.84 132.75 42.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.442 -0.786 . . . . 0.0 110.314 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -67.66 -39.7 84.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.684 -0.635 . . . . 0.0 109.58 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.41 145.05 56.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.465 -0.772 . . . . 0.0 110.122 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.68 -163.03 8.28 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.491 ' N ' HD12 ' A' ' 85' ' ' LEU . 10.1 mp -73.81 141.34 46.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.237 -1.155 . . . . 0.0 109.036 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -159.03 114.06 2.49 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 109.25 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.555 ' O ' ' CD2' ' A' ' 87' ' ' HIS . 65.8 t60 -156.06 20.31 0.37 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.33 -0.856 . . . . 0.0 108.887 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -65.74 -40.52 92.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.464 -0.773 . . . . 0.0 109.625 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 51.92 179.65 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.436 -0.79 . . . . 0.0 110.021 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -66.22 -39.57 89.67 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.339 -0.851 . . . . 0.0 109.549 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -54.26 -79.06 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.219 -0.926 . . . . 0.0 110.079 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.553 -179.745 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.438 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 18.2 mmt . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 1' ' ' MET . 44.4 Cg_endo -63.93 147.1 92.07 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.391 2.061 . . . . 0.0 112.027 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.443 ' CG ' ' N ' ' A' ' 4' ' ' LYS . 9.0 p80 -152.17 -48.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.588 -0.695 . . . . 0.0 109.316 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.443 ' N ' ' CG ' ' A' ' 3' ' ' HIS . 22.6 pttp -81.49 151.51 27.77 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.303 -0.873 . . . . 0.0 109.75 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.41 147.76 39.73 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.257 -0.902 . . . . 0.0 109.23 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -77.37 -5.36 49.38 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.111 -0.993 . . . . 0.0 109.496 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -73.43 153.03 89.99 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 109.207 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -45.83 138.8 11.48 Favored 'Trans proline' 0 N--CA 1.495 1.568 0 C-N-CA 121.701 1.601 . . . . 0.0 112.066 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.95 -41.48 97.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.409 -0.807 . . . . 0.0 109.436 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -57.77 -46.02 85.14 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.387 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.1 -39.1 93.32 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.214 -0.929 . . . . 0.0 109.344 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.73 -52.58 62.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 110.011 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.96 -41.6 74.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.936 -1.102 . . . . 0.0 109.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -60.5 -44.91 95.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.477 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 m -62.33 -42.22 99.2 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.71 79.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -63.05 -44.81 99.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.129 -0.982 . . . . 0.0 109.404 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.14 -32.04 72.88 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.391 -0.818 . . . . 0.0 109.721 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.89 94.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.0 110.72 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 m -124.12 28.76 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.687 0 O-C-N 121.43 -0.794 . . . . 0.0 110.55 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.91 -34.13 62.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.844 -1.16 . . . . 0.0 110.086 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 23' ' ' ASP . 35.8 mtm-85 44.95 77.14 0.08 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.241 -0.912 . . . . 0.0 109.741 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 22' ' ' ARG . 83.9 m-20 57.69 150.39 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.946 0.879 . . . . 0.0 111.014 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.8 m 57.98 157.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.503 -0.748 . . . . 0.0 110.229 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.73 0.22 86.6 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.12 144.69 27.38 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.313 -1.11 . . . . 0.0 109.587 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.75 139.12 29.27 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.457 -0.777 . . . . 0.0 108.93 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.07 131.22 45.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.165 -0.959 . . . . 0.0 109.745 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.13 -37.5 74.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.509 -0.744 . . . . 0.0 109.589 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -57.19 -44.01 83.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.149 -0.969 . . . . 0.0 109.203 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.9 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.211 -0.931 . . . . 0.0 109.271 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.69 -48.32 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.285 -0.884 . . . . 0.0 109.355 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.38 86.56 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 m -62.94 -42.29 99.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.163 -1.198 . . . . 0.0 109.529 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.551 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 76.8 t80 -60.7 -47.09 87.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.352 -0.843 . . . . 0.0 109.476 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.4 mt -62.51 -42.09 99.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.086 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.66 -42.61 79.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.061 -1.025 . . . . 0.0 109.495 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.31 -42.19 96.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.15 -0.969 . . . . 0.0 109.561 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.551 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 81.0 m-20 -90.09 5.14 48.04 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.193 -0.942 . . . . 0.0 109.287 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 36' ' ' LEU . 49.2 t0 -162.7 73.13 2.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.34 -15.82 49.4 Favored 'Trans proline' 0 N--CA 1.489 1.262 0 C-N-CA 121.226 1.284 . . . . 0.0 111.006 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.1 m -74.49 -7.87 54.45 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -74.75 136.36 41.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.475 -0.765 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.12 92.67 45.78 Favored Pre-proline 0 N--CA 1.506 2.33 0 O-C-N 121.949 -0.469 . . . . 0.0 110.151 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -64.01 -16.31 54.16 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 122.061 1.841 . . . . 0.0 111.882 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.58 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 5.3 mpt_? -64.49 -39.88 94.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -63.48 -37.49 87.5 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -92.85 22.62 4.71 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.282 -0.886 . . . . 0.0 108.742 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.31 160.53 3.15 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -77.99 -18.5 55.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.345 -1.091 . . . . 0.0 109.57 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.43 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -135.83 -19.25 0.73 Allowed Glycine 0 N--CA 1.505 3.244 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -67.88 2.89 1.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.11 -1.229 . . . . 0.0 109.122 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 51' ' ' GLY . 64.4 tp -62.43 -38.35 89.39 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -58.95 -42.56 90.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.17 -0.956 . . . . 0.0 109.145 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -66.17 -30.37 70.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.534 -0.729 . . . . 0.0 109.775 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.7 75.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.856 -1.152 . . . . 0.0 110.046 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 57' ' ' VAL . 17.1 m -71.12 -17.96 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.246 -0.909 . . . . 0.0 109.801 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.67 -29.21 69.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.359 -0.838 . . . . 0.0 109.369 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.03 -32.22 73.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 63.3 mt -71.93 112.8 8.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 109.228 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.3 m-20 -64.4 -40.89 96.68 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.5 -0.75 . . . . 0.0 111.387 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -69.78 20.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.727 -1.233 . . . . 0.0 111.347 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.8 mt -137.82 133.48 34.02 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.222 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.474 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 89.2 m -97.58 135.28 39.63 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -118.11 132.92 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -134.87 117.86 16.33 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -97.65 119.35 36.06 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.548 -0.72 . . . . 0.0 109.191 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.6 m -102.67 122.29 44.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.571 -0.706 . . . . 0.0 109.357 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 133.49 43.77 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.987 -1.07 . . . . 0.0 109.227 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.1 t-20 -149.89 95.68 2.34 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.561 -0.712 . . . . 0.0 109.482 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 62.99 -139.47 44.78 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 t -83.85 -7.33 59.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.403 -1.057 . . . . 0.0 110.387 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -125.59 123.4 38.96 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.504 -0.748 . . . . 0.0 109.293 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -87.06 153.97 21.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.103 -0.998 . . . . 0.0 108.775 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -105.23 99.79 9.4 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.546 -0.721 . . . . 0.0 109.102 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.1 t -74.56 145.85 43.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.608 -0.683 . . . . 0.0 109.343 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -139.91 155.69 47.05 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.1 pt -133.33 151.05 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 CA-C-O 121.252 0.549 . . . . 0.0 109.592 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -151.94 141.48 21.69 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 19.8 mt -74.38 139.01 43.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.283 -0.885 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.474 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 22.4 mmt180 -64.51 -42.15 95.97 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.234 -0.916 . . . . 0.0 109.465 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -90.19 120.61 31.5 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.218 -0.926 . . . . 0.0 109.243 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -169.59 -26.65 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.236 -0.915 . . . . 0.0 109.319 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.53 -153.77 21.73 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.1 mt 51.48 86.72 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.232 -1.158 . . . . 0.0 109.755 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -168.74 -73.02 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.359 -0.838 . . . . 0.0 109.047 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -79.03 132.03 36.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.256 -0.903 . . . . 0.0 109.541 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.462 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 31.1 p-80 -155.05 163.66 39.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.443 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 85.9 t60 52.58 12.1 0.23 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.342 -0.849 . . . . 0.0 109.91 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.462 ' ND1' ' O ' ' A' ' 88' ' ' HIS . 65.8 m80 -93.44 74.55 4.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.237 -0.914 . . . . 0.0 109.178 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -66.9 -39.46 87.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.8 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 76.2 t60 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.784 -179.579 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mmm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.56 146.26 97.09 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.484 2.123 . . . . 0.0 112.466 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.73 125.8 1.22 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.398 -0.814 . . . . 0.0 109.094 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.76 114.9 20.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.106 -0.996 . . . . 0.0 109.537 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -69.29 -37.81 78.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.372 -0.83 . . . . 0.0 109.251 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -158.77 -48.59 0.06 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.251 -0.905 . . . . 0.0 108.804 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 57.68 172.3 0.05 OUTLIER Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.373 -0.829 . . . . 0.0 109.44 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.41 143.22 97.95 Favored 'Trans proline' 0 N--CA 1.502 2.022 0 C-N-CA 121.965 1.776 . . . . 0.0 111.921 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.0 mp -63.35 -43.94 96.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.144 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -63.76 -47.63 80.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.812 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -63.77 -35.76 81.65 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.363 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 ttt -64.15 -61.0 2.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.396 -0.815 . . . . 0.0 110.032 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -65.21 -39.95 93.47 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.15 -0.969 . . . . 0.0 109.974 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -61.12 -45.3 95.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.001 -1.062 . . . . 0.0 109.882 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -61.56 -43.56 98.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.023 -1.048 . . . . 0.0 109.981 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.55 -48.15 35.24 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 110.706 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.443 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.0 mt -63.11 -44.63 99.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 0.0 109.542 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -66.5 -35.16 79.57 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.304 -0.872 . . . . 0.0 109.936 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -38.65 91.97 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.0 110.02 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 m -110.41 11.54 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 121.608 -0.683 . . . . 0.0 109.789 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -59.82 -23.49 63.39 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.879 -1.138 . . . . 0.0 108.713 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 51.77 29.04 5.41 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.6 -0.688 . . . . 0.0 109.85 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 55.4 8.42 0.29 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.374 -0.829 . . . . 0.0 110.5 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.6 p -87.7 -3.52 58.96 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.812 -1.18 . . . . 0.0 108.804 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.66 -59.03 5.0 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.461 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 99.1 m95 -75.4 177.22 6.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.407 -1.055 . . . . 0.0 109.442 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 137.3 9.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.264 -0.898 . . . . 0.0 108.874 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -69.39 125.71 27.54 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.286 -0.884 . . . . 0.0 109.424 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.4 tp -57.73 -40.0 78.59 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.675 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -57.42 -42.27 82.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.064 -1.022 . . . . 0.0 109.132 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.17 89.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.221 -0.924 . . . . 0.0 109.528 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.63 -48.39 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 109.493 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.04 -42.7 99.88 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.1 p -66.25 -40.79 90.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -1.19 . . . . 0.0 109.967 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -61.61 -44.69 96.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.1 mt -61.41 -41.83 97.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.123 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.49 -39.55 84.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.346 -0.846 . . . . 0.0 109.094 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -61.6 -46.09 91.34 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.277 -0.889 . . . . 0.0 109.481 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -88.57 -4.51 58.57 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.145 -0.972 . . . . 0.0 109.167 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 36' ' ' LEU . 4.4 m-20 -153.56 64.28 4.87 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.0 -18.5 63.93 Favored 'Trans proline' 0 N--CA 1.494 1.506 0 C-N-CA 121.5 1.467 . . . . 0.0 111.034 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.0 m -76.14 -7.01 53.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 108.578 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -75.95 164.62 25.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.533 -0.73 . . . . 0.0 109.3 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -131.13 79.61 70.55 Favored Pre-proline 0 N--CA 1.504 2.261 0 O-C-N 121.611 -0.681 . . . . 0.0 110.116 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.17 -36.33 92.94 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.95 1.767 . . . . 0.0 111.142 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.58 -34.32 77.55 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.298 0.57 . . . . 0.0 110.158 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 49' ' ' GLY . 44.6 t30 -60.0 -36.59 77.54 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 108.99 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -78.36 24.56 0.26 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.243 -0.911 . . . . 0.0 109.265 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 74.51 161.8 8.48 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.513 ' C ' ' H ' ' A' ' 52' ' ' ARG . 99.5 m-70 -90.7 123.84 34.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.273 -1.134 . . . . 0.0 109.558 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 69.59 -21.63 0.43 Allowed Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 50' ' ' HIS . 76.2 mtp85 -71.39 -1.88 14.57 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.185 -1.185 . . . . 0.0 109.007 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.9 tp -61.77 -37.71 85.33 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -58.89 -41.97 88.44 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.361 -0.837 . . . . 0.0 109.319 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -65.65 -31.65 72.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.191 -0.943 . . . . 0.0 109.862 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.7 tpt -64.78 -48.6 73.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.87 -1.144 . . . . 0.0 109.962 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.0 m -75.14 -16.27 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.116 -0.99 . . . . 0.0 109.678 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -60.92 -28.13 68.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.424 -0.797 . . . . 0.0 109.688 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -70.37 -3.3 16.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.133 -0.979 . . . . 0.0 109.006 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.0 mt -99.92 124.59 45.41 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.499 -0.75 . . . . 0.0 109.058 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.7 p-10 -73.44 -36.63 65.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.441 -0.787 . . . . 0.0 111.622 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.461 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 51.6 p90 -73.5 18.81 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.684 -1.26 . . . . 0.0 110.907 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.6 mt -136.33 125.03 23.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.318 -0.864 . . . . 0.0 109.165 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.8 m -89.31 141.95 28.09 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.367 -0.833 . . . . 0.0 109.09 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.5 t -116.06 130.35 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.618 0.723 . . . . 0.0 109.396 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.461 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 51.1 tt0 -153.78 150.63 28.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -140.48 127.91 21.32 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.384 -0.823 . . . . 0.0 109.079 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.7 p -81.71 154.45 26.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.889 -1.132 . . . . 0.0 108.724 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.606 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -90.34 132.45 35.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.215 -0.928 . . . . 0.0 108.711 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -150.66 98.82 2.67 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.886 -1.134 . . . . 0.0 109.643 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 55.51 -140.89 39.54 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 62.1 m -86.32 -7.84 58.17 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.26 -1.141 . . . . 0.0 109.655 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -103.14 118.21 36.28 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.339 -0.851 . . . . 0.0 109.491 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.11 134.82 33.47 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -100.87 104.31 15.53 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 m -74.2 148.84 41.26 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.435 -0.791 . . . . 0.0 109.174 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -141.5 152.04 43.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.426 -0.796 . . . . 0.0 108.945 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.3 pt -139.97 152.12 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.659 -0.65 . . . . 0.0 109.437 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -157.04 154.76 30.05 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.93 138.18 58.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.116 -0.99 . . . . 0.0 109.757 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.8 ttp85 -70.65 81.38 0.6 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 109.799 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -161.21 157.53 25.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.423 -0.798 . . . . 0.0 109.267 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 53.12 34.08 16.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.428 -0.795 . . . . 0.0 109.67 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -157.26 91.26 0.12 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.492 ' N ' HD22 ' A' ' 85' ' ' LEU . 3.8 mm? -88.11 -1.03 57.76 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.211 -1.17 . . . . 0.0 109.016 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 85' ' ' LEU . 24.8 mp0 53.63 105.93 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.55 0.691 . . . . 0.0 110.23 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -70.81 149.46 46.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.205 -0.934 . . . . 0.0 109.448 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.6 m80 52.24 178.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.465 -0.772 . . . . 0.0 109.996 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -85.53 144.07 28.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.159 -0.963 . . . . 0.0 109.832 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -71.95 142.72 49.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.409 -0.807 . . . . 0.0 109.581 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -72.68 141.27 48.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.249 -0.907 . . . . 0.0 109.836 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.106 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.487 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.0 mpt? . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 26.6 Cg_exo -61.39 144.9 98.55 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.468 2.112 . . . . 0.0 111.953 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' O ' ' N ' ' A' ' 5' ' ' GLU . 88.2 m-70 -159.07 -61.07 0.07 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.341 -0.85 . . . . 0.0 109.342 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt 59.16 -73.1 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.163 0 CA-C-O 121.123 0.487 . . . . 0.0 110.225 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 3' ' ' HIS . 82.4 tt0 -62.5 -91.5 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.034 -1.042 . . . . 0.0 109.914 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 pttt -97.67 126.06 42.79 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.274 -0.891 . . . . 0.0 110.66 -179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.574 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.06 -34.16 0.39 Allowed Pre-proline 0 N--CA 1.5 2.047 0 O-C-N 121.562 -0.711 . . . . 0.0 110.203 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 44.6 Cg_exo -58.41 127.9 26.44 Favored 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 121.095 1.197 . . . . 0.0 112.055 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.53 -40.27 80.81 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.464 -0.773 . . . . 0.0 109.091 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -56.82 -45.63 82.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -0.94 . . . . 0.0 109.307 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -65.0 -36.97 86.13 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.355 -0.841 . . . . 0.0 109.217 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.4 ttp -62.66 -53.74 49.93 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.418 -0.801 . . . . 0.0 110.0 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -70.7 -41.5 71.89 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.917 -1.115 . . . . 0.0 110.123 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.2 m -60.58 -45.89 92.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.883 -1.135 . . . . 0.0 110.119 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -61.41 -45.15 95.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.47 77.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.204 -0.935 . . . . 0.0 111.106 -178.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.1 mt -61.87 -46.96 95.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.114 -0.991 . . . . 0.0 109.451 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.88 -29.23 69.07 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.433 -0.792 . . . . 0.0 109.8 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.22 -42.89 96.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.149 -0.97 . . . . 0.0 110.708 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ARG . 12.6 m -111.98 20.45 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.512 -0.742 . . . . 0.0 109.989 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 2.82 1.31 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.825 -1.172 . . . . 0.0 109.321 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.0 mmt180 61.19 -146.34 0.44 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -59.9 -49.99 75.54 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.626 -0.671 . . . . 0.0 110.178 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t 176.76 87.72 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.284 -0.885 . . . . 0.0 108.804 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.59 -171.2 38.59 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.468 -1.348 . . . . 0.0 109.888 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -58.77 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.67 -0.9 . . . . 0.0 109.556 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.69 142.36 30.01 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.462 -0.774 . . . . 0.0 109.166 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.93 132.85 48.09 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.161 -0.962 . . . . 0.0 110.085 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.27 -39.79 80.14 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.206 -0.934 . . . . 0.0 109.275 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.5 p -55.8 -42.4 75.54 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 109.241 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.39 87.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.582 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.29 -48.29 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.096 -1.003 . . . . 0.0 109.901 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.61 -46.74 93.49 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -64.76 -42.89 94.78 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.109 -1.23 . . . . 0.0 110.094 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -61.21 -48.4 81.67 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.232 -0.917 . . . . 0.0 109.736 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 40' ' ' ASP . 90.1 mt -63.12 -41.97 99.44 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.396 -0.815 . . . . 0.0 109.11 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.33 93.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 108.936 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -64.14 -44.77 91.15 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.295 -0.878 . . . . 0.0 109.707 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -82.99 -8.24 59.58 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.188 -0.945 . . . . 0.0 109.494 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.48 ' N ' ' O ' ' A' ' 36' ' ' LEU . 5.1 m-20 -153.76 77.22 5.83 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.37 -30.29 62.46 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.804 1.669 . . . . 0.0 111.115 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 83.6 p -69.01 -12.47 61.72 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.617 -0.677 . . . . 0.0 109.678 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -76.84 122.85 25.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.975 . . . . 0.0 108.399 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -115.41 96.77 46.82 Favored Pre-proline 0 N--CA 1.506 2.368 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.7 -7.42 20.12 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 CA-C-N 120.187 1.103 . . . . 0.0 111.254 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -62.79 -41.45 99.28 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -62.76 -37.48 86.77 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.439 -0.788 . . . . 0.0 109.151 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -81.51 26.4 0.47 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.274 -0.891 . . . . 0.0 109.359 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 56.75 98.91 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -48.93 -28.66 3.99 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -1.187 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.47 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -96.18 -55.54 1.27 Allowed Glycine 0 N--CA 1.502 3.072 0 N-CA-C 108.771 -1.731 . . . . 0.0 108.771 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -62.94 2.75 0.28 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.39 -1.065 . . . . 0.0 109.607 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 51' ' ' GLY . 57.4 tp -60.44 -42.23 95.69 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.2 t -62.91 -25.93 68.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.489 -0.757 . . . . 0.0 109.739 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -85.09 -34.97 22.1 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 120.976 -1.077 . . . . 0.0 110.056 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.69 -43.58 88.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.887 -1.133 . . . . 0.0 109.872 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 m -63.33 -20.65 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.082 -1.011 . . . . 0.0 109.647 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -69.45 -19.78 63.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.357 -0.839 . . . . 0.0 109.537 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -86.6 0.4 54.51 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.204 -0.935 . . . . 0.0 109.616 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' PHE . 90.5 mt -85.44 -5.48 59.29 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.922 -1.111 . . . . 0.0 109.015 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 63' ' ' LEU . 8.6 m-20 57.85 -65.29 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.526 -0.734 . . . . 0.0 111.958 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 60' ' ' LEU . 52.6 p90 -63.21 19.07 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.63 -1.294 . . . . 0.0 111.999 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 61' ' ' ASP . 8.1 mt -136.21 128.91 30.8 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.061 -1.024 . . . . 0.0 108.875 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 60.8 m -89.26 140.74 29.18 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.8 t -119.18 131.52 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 O-C-N 121.482 -0.761 . . . . 0.0 109.239 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -141.56 151.85 43.56 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.92 120.03 41.13 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -91.57 151.03 20.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.243 -0.911 . . . . 0.0 108.57 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 69' ' ' ARG . 15.0 mtm180 -91.85 114.27 26.76 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -149.99 118.01 6.32 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.267 -0.896 . . . . 0.0 110.161 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.68 -171.11 2.55 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.2 m -78.41 28.94 0.19 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.412 -1.052 . . . . 0.0 109.61 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -144.78 119.56 9.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.301 -0.874 . . . . 0.0 109.076 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 mt -68.12 132.68 47.64 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 m170 -101.31 119.13 38.29 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.557 -0.714 . . . . 0.0 109.229 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.3 t -71.41 149.74 45.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 109.397 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -141.2 148.76 40.47 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -133.64 147.32 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.558 -0.714 . . . . 0.0 109.563 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -157.98 154.02 27.08 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.29 136.85 57.08 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -66.54 -24.95 66.45 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -65.33 -42.89 92.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.219 -0.926 . . . . 0.0 109.697 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -90.19 112.28 23.73 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.265 -0.897 . . . . 0.0 109.627 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.403 ' O ' ' O ' ' A' ' 85' ' ' LEU . . . 158.76 0.53 0.08 OUTLIER Glycine 0 N--CA 1.496 2.684 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.403 ' O ' ' O ' ' A' ' 84' ' ' GLY . 45.2 mt 53.69 100.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.556 -0.967 . . . . 0.0 109.159 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.57 138.88 57.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.842 . . . . 0.0 110.169 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -167.15 117.52 0.87 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 108.932 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -77.55 130.21 36.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.02 -1.05 . . . . 0.0 109.308 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -70.99 134.85 47.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.156 -0.965 . . . . 0.0 109.609 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.434 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 58.3 t-80 -77.78 50.89 0.88 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.2 -0.937 . . . . 0.0 109.598 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.3 m170 51.3 -175.53 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.476 -0.765 . . . . 0.0 110.47 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.382 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.554 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 3.8 ttm . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.554 ' CD ' ' N ' ' A' ' 1' ' ' MET . 24.6 Cg_exo -64.57 6.28 0.35 Allowed 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.24 1.96 . . . . 0.0 111.704 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.467 ' C ' ' H ' ' A' ' 5' ' ' GLU . 97.9 m-70 -67.44 -35.61 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.208 -0.933 . . . . 0.0 109.71 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -70.92 37.99 0.05 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.183 -0.948 . . . . 0.0 110.046 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.467 ' H ' ' C ' ' A' ' 3' ' ' HIS . 79.4 tt0 -77.56 -79.1 0.12 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.024 -1.048 . . . . 0.0 108.509 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 50.58 -110.81 0.48 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.341 -0.849 . . . . 0.0 110.267 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -74.37 153.28 87.99 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.077 -1.014 . . . . 0.0 109.14 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -47.84 135.04 23.02 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.353 1.369 . . . . 0.0 111.969 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.9 -42.69 97.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.171 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -59.97 -47.82 84.22 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.251 -0.906 . . . . 0.0 109.437 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.3 -35.44 80.38 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.724 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.58 -50.83 69.73 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.279 -0.888 . . . . 0.0 110.35 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -69.16 -48.68 61.61 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.859 -1.151 . . . . 0.0 110.312 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.4 p -60.65 -43.84 97.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.975 -1.078 . . . . 0.0 110.257 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m -60.64 -44.32 96.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.11 -0.994 . . . . 0.0 110.176 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.54 -41.96 75.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 110.505 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 21' ' ' ALA . 93.6 mt -63.64 -46.18 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.161 -0.962 . . . . 0.0 109.93 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.66 -33.96 77.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.025 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.64 91.71 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.166 -0.959 . . . . 0.0 109.913 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.1 m -101.74 -2.78 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 O-C-N 121.364 -0.835 . . . . 0.0 109.968 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.506 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -62.12 -23.45 66.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.966 -1.084 . . . . 0.0 108.896 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 61.74 -2.97 0.24 Allowed 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.402 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.506 ' H ' ' C ' ' A' ' 21' ' ' ALA . 8.8 p30 -175.11 -101.41 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.799 -1.188 . . . . 0.0 108.827 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.48 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 29.9 t -162.02 91.96 0.82 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.925 -1.109 . . . . 0.0 108.89 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.09 -149.35 8.23 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.418 ' CH2' ' CD ' ' A' ' 66' ' ' GLN . 99.2 m95 -68.04 -178.44 1.01 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.632 -0.922 . . . . 0.0 110.044 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -159.57 149.92 19.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.372 -0.83 . . . . 0.0 108.912 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 40.6 mp0 -76.98 128.42 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.244 -0.91 . . . . 0.0 109.581 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.85 -39.85 78.69 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -55.63 -43.0 75.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.067 -1.021 . . . . 0.0 109.612 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.22 90.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.131 -0.98 . . . . 0.0 109.546 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.3 t -62.7 -48.22 89.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.163 -0.961 . . . . 0.0 109.544 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.85 -48.65 85.19 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -63.2 -42.63 99.35 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.179 -1.189 . . . . 0.0 109.505 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.401 ' CZ ' ' OD1' ' A' ' 39' ' ' ASN . 83.7 t80 -60.12 -45.51 92.75 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.851 . . . . 0.0 109.505 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 40' ' ' ASP . 66.5 mt -61.67 -43.06 99.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.963 . . . . 0.0 109.187 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.46 91.0 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.16 -0.962 . . . . 0.0 109.132 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.9 -44.69 95.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.885 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.401 ' OD1' ' CZ ' ' A' ' 35' ' ' TYR . 33.5 m120 -89.61 2.04 55.21 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.247 -0.908 . . . . 0.0 109.226 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 36' ' ' LEU . 50.0 t0 -162.81 73.8 2.06 Favored Pre-proline 0 N--CA 1.493 1.696 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.03 -14.96 45.51 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.405 1.403 . . . . 0.0 111.306 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 88.2 p -74.95 -8.96 58.01 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -72.94 141.09 47.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.428 -0.795 . . . . 0.0 109.385 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -119.72 92.56 46.53 Favored Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.67 -0.644 . . . . 0.0 109.919 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.09 -19.29 40.38 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.009 1.806 . . . . 0.0 111.525 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -63.72 -36.53 84.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.505 -0.747 . . . . 0.0 109.199 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.02 -36.24 82.91 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.114 -0.991 . . . . 0.0 108.471 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -78.57 7.21 7.11 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.829 . . . . 0.0 109.394 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.92 152.23 0.04 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.449 ' C ' ' H ' ' A' ' 52' ' ' ARG . 59.3 t-80 -78.41 132.15 37.22 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -1.029 . . . . 0.0 109.603 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.57 -32.61 0.85 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.449 ' H ' ' C ' ' A' ' 50' ' ' HIS . 64.5 ttt180 -67.12 -12.01 58.8 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.272 -1.134 . . . . 0.0 108.49 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -61.34 -42.96 99.54 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 108.587 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -62.47 -42.82 99.75 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -69.14 -32.23 71.44 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.953 . . . . 0.0 109.918 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -46.31 88.99 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.095 -1.003 . . . . 0.0 109.783 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.1 -24.74 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.171 -0.955 . . . . 0.0 109.246 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.95 -29.27 69.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.504 -0.747 . . . . 0.0 109.725 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -70.87 -3.04 17.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.951 . . . . 0.0 109.783 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 64.2 mt -102.38 125.01 48.96 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 35.4 p-10 -68.19 -38.7 82.3 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.341 -0.85 . . . . 0.0 111.536 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.419 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 45.2 p90 -76.45 16.0 0.54 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.715 -1.24 . . . . 0.0 110.433 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.408 HD13 ' N ' ' A' ' 64' ' ' THR . 0.7 OUTLIER -133.53 117.04 16.66 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.324 -0.86 . . . . 0.0 109.053 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.408 ' N ' HD13 ' A' ' 63' ' ' LEU . 62.7 m -90.4 141.81 28.36 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.213 -0.929 . . . . 0.0 109.711 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.5 t -126.7 133.79 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CD ' ' CH2' ' A' ' 26' ' ' TRP . 86.6 mt-30 -141.05 137.04 32.62 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -102.37 121.18 41.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.52 -0.737 . . . . 0.0 109.122 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.8 m -92.45 141.74 28.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.279 -0.888 . . . . 0.0 108.998 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.593 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -88.11 90.42 8.38 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.269 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -99.61 106.3 18.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.023 . . . . 0.0 109.676 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.33 -138.76 47.48 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.94 -8.4 57.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.273 -1.133 . . . . 0.0 109.802 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -113.0 122.77 48.61 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.441 -0.787 . . . . 0.0 109.805 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mp -85.01 131.51 34.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -107.7 125.61 51.59 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-O 121.521 0.677 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 t -70.8 154.64 41.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.547 -0.72 . . . . 0.0 109.635 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -137.84 154.86 49.46 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.9 pt -136.99 151.42 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 CA-C-O 121.444 0.64 . . . . 0.0 109.673 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.1 ttp85 -151.19 144.9 25.04 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.4 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -90.49 113.41 25.37 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.301 -0.874 . . . . 0.0 109.236 -178.84 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.4 ' N ' HD13 ' A' ' 80' ' ' LEU . 61.6 ttm-85 -75.89 89.73 2.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.938 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.427 ' H ' ' H ' ' A' ' 83' ' ' ASP . 55.6 t-80 -170.93 -5.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.427 ' H ' ' H ' ' A' ' 82' ' ' HIS . 35.8 p30 -80.42 -3.09 48.44 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.391 -0.818 . . . . 0.0 109.72 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -76.09 93.1 0.96 Allowed Glycine 0 N--CA 1.495 2.606 0 N-CA-C 109.008 -1.637 . . . . 0.0 109.008 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.5 mt -83.28 137.8 33.84 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.173 -1.192 . . . . 0.0 109.674 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 49.19 -166.26 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.407 -0.808 . . . . 0.0 110.324 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -136.57 132.29 34.96 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.583 -0.698 . . . . 0.0 109.219 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -154.15 165.83 35.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.404 -0.81 . . . . 0.0 109.309 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 52.2 m170 51.98 78.99 0.11 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.476 -0.765 . . . . 0.0 109.871 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -153.44 10.65 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.488 -0.757 . . . . 0.0 109.054 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -66.08 -42.14 89.78 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.897 . . . . 0.0 109.858 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 59.6 t-80 . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.474 -179.87 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 tpt . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.1 144.97 99.41 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.462 2.108 . . . . 0.0 111.999 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -75.02 -78.66 0.1 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.172 -0.955 . . . . 0.0 109.382 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.614 ' C ' ' H ' ' A' ' 6' ' ' LYS . 68.7 mttm -64.97 -43.62 92.04 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.506 -0.746 . . . . 0.0 110.17 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 62.25 -19.06 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.795 -0.566 . . . . 0.0 110.018 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.614 ' H ' ' C ' ' A' ' 4' ' ' LYS . 37.2 ttpt -65.82 -43.81 87.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.961 -1.087 . . . . 0.0 110.383 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.418 ' ND1' ' O ' ' A' ' 6' ' ' LYS . 25.0 m-70 -157.18 153.94 24.86 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 121.069 -1.019 . . . . 0.0 109.085 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -45.03 138.02 9.26 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 121.573 1.516 . . . . 0.0 112.386 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 mt -63.58 -40.94 98.25 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.491 -0.755 . . . . 0.0 109.167 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.54 -38.39 77.69 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.472 -0.768 . . . . 0.0 108.947 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -61.73 -42.08 98.49 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.315 -0.865 . . . . 0.0 109.351 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.413 ' SD ' HD22 ' A' ' 36' ' ' LEU . 47.9 mmm -63.54 -44.85 93.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.137 -0.977 . . . . 0.0 109.326 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -69.5 -44.31 71.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.182 -0.949 . . . . 0.0 110.094 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.7 m -62.75 -46.23 89.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.058 -1.026 . . . . 0.0 110.206 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -67.71 -39.1 84.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.283 -0.886 . . . . 0.0 110.202 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -75.47 -48.89 20.64 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.048 -1.032 . . . . 0.0 110.897 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.15 -45.0 99.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.047 -1.033 . . . . 0.0 109.347 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.86 -31.76 72.58 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.383 -0.823 . . . . 0.0 109.71 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.52 96.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.986 -1.071 . . . . 0.0 110.303 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.1 m -118.97 23.94 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.477 -0.764 . . . . 0.0 109.613 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.04 -33.49 70.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.905 -1.122 . . . . 0.0 109.372 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 24' ' ' SER . 20.5 mtm180 51.8 97.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.819 . . . . 0.0 110.476 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 51.07 -82.7 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 110.668 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' ARG . 11.6 p -65.14 157.86 27.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.184 -0.948 . . . . 0.0 109.642 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.1 1.85 78.34 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.411 ' CH2' ' OE1' ' A' ' 66' ' ' GLN . 96.5 m95 -85.03 148.8 25.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.074 -1.25 . . . . 0.0 109.26 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.41 145.68 31.23 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.359 -0.838 . . . . 0.0 109.027 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.14 132.35 46.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.897 . . . . 0.0 109.497 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 53' ' ' LEU . 31.2 tp -56.73 -39.94 74.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.46 -0.775 . . . . 0.0 109.275 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.6 m -58.57 -44.04 89.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.141 -0.974 . . . . 0.0 109.267 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.38 -36.48 80.37 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 109.593 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.42 -48.24 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.232 -0.917 . . . . 0.0 109.312 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.82 -48.78 78.3 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.2 t -62.17 -45.11 94.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.125 -1.22 . . . . 0.0 109.745 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.616 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 74.7 t80 -60.09 -48.53 81.34 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.295 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.413 HD22 ' SD ' ' A' ' 12' ' ' MET . 98.2 mt -65.93 -39.56 90.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 109.382 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.53 75.98 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.057 -1.027 . . . . 0.0 109.824 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -62.44 -41.08 98.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.075 -1.016 . . . . 0.0 109.526 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.616 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 74.2 m-20 -64.36 -40.28 95.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.221 -0.924 . . . . 0.0 109.353 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.28 152.58 58.36 Favored Pre-proline 0 N--CA 1.497 1.922 0 O-C-N 121.19 -0.944 . . . . 0.0 108.683 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -45.97 -43.91 19.4 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.439 1.426 . . . . 0.0 111.312 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.9 m -145.65 -92.82 0.09 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.55 ' CZ ' ' NZ ' ' A' ' 4' ' ' LYS . 54.6 t80 61.81 144.71 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.912 0.863 . . . . 0.0 108.99 -179.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -158.76 94.35 1.87 Allowed Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 121.536 -0.727 . . . . 0.0 109.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -70.35 -22.77 28.9 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 CA-C-N 119.536 0.87 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -66.05 -51.68 56.0 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.321 -0.862 . . . . 0.0 109.423 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -64.0 -11.23 27.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.238 -0.914 . . . . 0.0 110.341 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.451 ' HE3' ' HE ' ' A' ' 52' ' ' ARG . 2.4 m95 -81.16 3.01 25.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.904 -1.123 . . . . 0.0 108.954 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.47 164.2 12.6 Favored Glycine 0 N--CA 1.51 3.623 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -73.24 129.36 37.88 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.314 -1.109 . . . . 0.0 109.83 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . 83.82 -89.87 1.57 Allowed Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.451 ' HE ' ' HE3' ' A' ' 48' ' ' TRP . 1.2 tmt_? 50.14 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.994 -0.709 . . . . 0.0 110.613 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.561 ' N ' ' O ' ' A' ' 51' ' ' GLY . 41.6 tp -49.37 -35.99 20.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.0 t -66.58 -36.53 82.86 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.295 0.569 . . . . 0.0 109.649 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -86.2 -32.44 21.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.995 -1.066 . . . . 0.0 110.244 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.8 mtp -64.38 -38.95 92.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.009 -1.057 . . . . 0.0 108.825 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.2 -26.78 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 120.757 -1.214 . . . . 0.0 110.069 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.35 -40.43 82.17 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.187 -0.946 . . . . 0.0 110.635 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -75.43 -0.47 20.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.923 -1.11 . . . . 0.0 110.263 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.1 mt -102.65 115.42 30.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.234 -0.917 . . . . 0.0 109.267 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.409 ' C ' ' H ' ' A' ' 63' ' ' LEU . 68.0 t0 -65.87 -42.5 90.3 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.355 -0.841 . . . . 0.0 111.473 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -71.87 15.32 0.15 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.868 -1.145 . . . . 0.0 110.806 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.412 HD13 ' N ' ' A' ' 64' ' ' THR . 0.6 OUTLIER -129.23 117.87 21.43 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.391 -0.818 . . . . 0.0 108.954 -179.229 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.412 ' N ' HD13 ' A' ' 63' ' ' LEU . 51.0 m -88.2 144.74 26.27 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.302 -0.874 . . . . 0.0 109.29 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 49.1 t -118.69 130.79 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 CA-C-O 121.531 0.681 . . . . 0.0 109.851 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.411 ' OE1' ' CH2' ' A' ' 26' ' ' TRP . 49.8 tt0 -145.13 152.64 40.37 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.492 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 54.7 mp0 -127.73 118.11 23.18 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 p -79.43 153.73 29.47 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.158 -0.964 . . . . 0.0 108.433 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 69' ' ' ARG . 22.4 mtt180 -96.24 134.6 39.15 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -150.05 101.82 3.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.291 -0.881 . . . . 0.0 109.623 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.12 -140.73 44.49 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.9 p -86.44 -7.88 58.07 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.283 -1.128 . . . . 0.0 109.828 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -118.67 110.45 17.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.596 -0.69 . . . . 0.0 109.627 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.51 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -81.03 149.09 29.41 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.483 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -107.46 129.56 54.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.513 -0.742 . . . . 0.0 109.364 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.6 p -70.62 151.57 44.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.451 -0.781 . . . . 0.0 109.395 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -144.36 156.27 44.16 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.0 pt -138.29 155.02 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.479 -0.763 . . . . 0.0 109.852 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -154.21 146.99 24.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.386 -0.821 . . . . 0.0 108.804 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 69.0 mt -69.05 136.3 52.16 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.218 -0.926 . . . . 0.0 108.634 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -78.56 133.08 37.37 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.274 -0.891 . . . . 0.0 109.639 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -166.43 -176.05 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.41 -0.806 . . . . 0.0 108.889 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t0 54.23 13.23 0.58 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.98 105.56 3.2 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.464 ' O ' ' ND1' ' A' ' 87' ' ' HIS . 34.3 mt -86.25 -4.94 59.27 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.171 -1.194 . . . . 0.0 108.862 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 52.39 -95.54 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.513 -0.742 . . . . 0.0 110.037 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.464 ' ND1' ' O ' ' A' ' 85' ' ' LEU . 57.6 m80 51.01 94.79 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.069 -1.019 . . . . 0.0 109.57 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -65.93 134.64 53.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.227 -0.921 . . . . 0.0 109.034 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -64.76 -42.39 95.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.244 -0.91 . . . . 0.0 109.547 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -91.24 105.44 17.79 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.286 -0.884 . . . . 0.0 109.49 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -168.53 -37.48 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 109.315 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.433 -179.894 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.55 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 1' ' ' MET . 31.2 Cg_exo -62.0 145.0 96.9 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.269 1.979 . . . . 0.0 112.363 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -66.96 -37.52 84.42 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.186 -0.946 . . . . 0.0 109.649 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -68.36 138.66 55.57 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.315 -0.866 . . . . 0.0 109.067 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -81.38 -129.34 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.284 -0.885 . . . . 0.0 109.063 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.72 -81.22 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.95 -1.094 . . . . 0.0 109.734 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.94 152.09 58.57 Favored Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.192 -0.943 . . . . 0.0 109.413 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.35 134.94 15.83 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.608 1.539 . . . . 0.0 112.099 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.38 -41.32 96.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.379 -0.826 . . . . 0.0 109.455 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.33 -41.76 72.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.209 -0.932 . . . . 0.0 109.53 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -65.26 -44.51 87.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.15 -0.969 . . . . 0.0 108.635 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 81.3 mtp -62.55 -49.05 76.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.862 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -68.64 -42.89 77.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.001 -1.062 . . . . 0.0 109.829 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -63.2 -48.05 79.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.942 -1.099 . . . . 0.0 109.993 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.0 p -65.93 -40.32 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.09 -1.006 . . . . 0.0 110.223 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.47 -48.66 31.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.094 -1.004 . . . . 0.0 110.74 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.6 mt -62.88 -45.03 99.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 109.495 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -66.37 -32.83 74.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.58 91.61 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.138 -0.977 . . . . 0.0 110.361 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.3 m -117.96 20.15 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.506 -0.746 . . . . 0.0 109.812 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.14 -27.32 66.97 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.056 -1.027 . . . . 0.0 109.662 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 51.21 85.81 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.724 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 25' ' ' GLY . 31.8 t70 52.78 38.8 27.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.07 -1.019 . . . . 0.0 110.499 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 26' ' ' TRP . 4.1 p 62.01 1.24 0.64 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.86 . . . . 0.0 109.688 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 23' ' ' ASP . . . -68.46 76.08 0.27 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.68 ' H ' ' NH2' ' A' ' 79' ' ' ARG . 88.7 m95 40.7 -165.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.896 -0.767 . . . . 0.0 111.216 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.74 133.03 10.85 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -71.38 125.98 28.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 109.577 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.6 tp -54.66 -40.29 68.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 109.265 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -58.53 -43.6 89.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.173 -0.955 . . . . 0.0 109.092 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.28 93.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 109.541 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.95 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.04 -1.037 . . . . 0.0 109.064 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.98 85.71 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.2 t -61.78 -43.37 98.98 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.159 -1.201 . . . . 0.0 109.729 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.567 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 72.2 t80 -59.52 -46.7 88.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.278 -0.889 . . . . 0.0 109.549 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.1 mt -63.24 -40.4 97.33 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.287 -0.883 . . . . 0.0 109.209 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.09 -47.86 65.02 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.94 -1.1 . . . . 0.0 109.58 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -63.89 -41.41 97.71 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 109.298 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.567 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 83.6 m-20 -89.02 8.39 29.92 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.047 -1.033 . . . . 0.0 109.253 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.476 ' N ' ' O ' ' A' ' 36' ' ' LEU . 45.0 t0 -153.38 78.44 5.74 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.335 -0.853 . . . . 0.0 109.173 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.415 ' O ' ' CB ' ' A' ' 42' ' ' SER . 21.1 Cg_exo -62.96 156.52 53.89 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.35 2.033 . . . . 0.0 111.54 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 41' ' ' PRO . 0.9 OUTLIER 75.05 2.68 4.02 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.719 -0.613 . . . . 0.0 109.373 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -93.2 -71.26 0.66 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 55.16 89.42 0.11 Allowed Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.656 -0.652 . . . . 0.0 109.518 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 49' ' ' GLY . 50.8 Cg_exo -54.37 -36.68 88.0 Favored 'Trans proline' 0 N--CA 1.499 1.801 0 C-N-CA 122.246 1.964 . . . . 0.0 111.238 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -58.96 -44.7 91.51 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -47.83 -32.71 6.42 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.345 -0.847 . . . . 0.0 109.921 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 25.5 p-90 -134.37 31.89 3.43 Favored 'General case' 0 N--CA 1.504 2.225 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -61.9 -76.86 0.22 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.468 ' O ' ' ND1' ' A' ' 50' ' ' HIS . 62.7 t-80 55.19 3.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.686 -0.89 . . . . 0.0 110.447 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 49' ' ' GLY . . . 74.35 -18.29 2.2 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.535 ' HG3' HH11 ' A' ' 52' ' ' ARG . 8.9 ptm180 -61.08 -3.92 0.95 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.126 -1.22 . . . . 0.0 109.195 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 51' ' ' GLY . 58.8 tp -62.67 -44.25 96.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.315 -0.866 . . . . 0.0 108.806 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.6 p -65.13 -34.83 79.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.334 -0.854 . . . . 0.0 109.353 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -74.87 -33.53 62.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.024 . . . . 0.0 109.507 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.77 -46.79 86.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.873 -1.142 . . . . 0.0 109.585 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.0 -23.9 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.376 -0.827 . . . . 0.0 109.826 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.16 -32.1 71.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.28 -0.888 . . . . 0.0 109.433 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -70.88 -1.91 13.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.141 -0.974 . . . . 0.0 109.616 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -103.65 122.8 45.77 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.427 -0.795 . . . . 0.0 108.908 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.458 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.2 p-10 -73.89 -37.5 64.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.414 -0.804 . . . . 0.0 111.582 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.458 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 50.2 p90 -72.19 19.29 0.07 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.653 -1.28 . . . . 0.0 110.976 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.435 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.0 mt -137.62 125.86 23.14 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.442 -0.786 . . . . 0.0 108.974 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.4 m -92.5 133.56 35.81 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.01 130.87 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.33 0 CA-C-O 121.545 0.688 . . . . 0.0 109.513 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -149.7 144.4 26.07 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.21 122.68 47.01 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.457 -0.777 . . . . 0.0 109.139 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.9 m -78.77 149.54 32.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 109.403 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.57 126.24 33.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.609 -0.682 . . . . 0.0 109.294 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -149.91 89.62 1.62 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.335 -0.853 . . . . 0.0 109.883 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.36 -140.67 46.67 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.0 p -86.5 -7.55 58.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.197 -1.178 . . . . 0.0 109.992 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -102.98 122.8 45.36 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.3 mt -87.15 129.4 34.95 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -98.12 116.79 31.07 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.388 -0.82 . . . . 0.0 109.228 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.7 m -71.96 144.37 48.92 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.499 -0.751 . . . . 0.0 109.186 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -143.39 150.99 39.88 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.22 149.58 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.609 -0.682 . . . . 0.0 109.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.68 ' NH2' ' H ' ' A' ' 26' ' ' TRP . 6.9 ptp180 -155.42 156.49 35.43 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.5 137.22 46.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.893 . . . . 0.0 109.26 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -63.51 -42.14 98.49 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.527 -0.733 . . . . 0.0 109.935 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -56.94 -42.27 79.77 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.923 . . . . 0.0 109.804 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -79.61 -5.3 54.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.146 -0.971 . . . . 0.0 109.611 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.2 -3.02 90.74 Favored Glycine 0 N--CA 1.497 2.73 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.59 126.94 31.86 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.01 -1.288 . . . . 0.0 109.388 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -76.37 145.87 39.13 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.436 -0.79 . . . . 0.0 110.121 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 50.18 95.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.283 -0.886 . . . . 0.0 110.325 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.42 133.18 41.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.271 -0.893 . . . . 0.0 109.485 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -78.51 -6.05 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.201 -0.937 . . . . 0.0 109.494 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -60.45 -42.67 96.64 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.196 -0.94 . . . . 0.0 109.65 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.482 ' O ' ' CG ' ' A' ' 92' ' ' HIS . 41.3 p-80 -151.73 15.68 0.67 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.089 -1.007 . . . . 0.0 109.552 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.482 ' CG ' ' O ' ' A' ' 91' ' ' HIS . 33.9 p80 . . . . . 0 N--CA 1.503 2.225 0 CA-C-O 117.956 -1.021 . . . . 0.0 111.006 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.516 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.53 149.53 84.3 Favored 'Trans proline' 0 N--CA 1.499 1.799 0 C-N-CA 122.178 1.918 . . . . 0.0 112.044 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 p80 -150.27 146.4 26.76 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.288 -0.882 . . . . 0.0 109.076 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -82.43 -83.17 0.13 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.193 -0.942 . . . . 0.0 109.796 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -171.3 146.33 2.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.435 -0.79 . . . . 0.0 109.084 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.59 -78.17 0.05 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.475 -0.766 . . . . 0.0 109.8 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -50.2 150.46 4.35 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.26 -0.9 . . . . 0.0 110.261 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -49.52 134.68 32.95 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 121.412 1.408 . . . . 0.0 112.148 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.472 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.8 mp -64.56 -41.35 96.36 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 108.989 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -56.39 -48.27 77.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 109.81 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.11 -39.2 92.77 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.193 -0.942 . . . . 0.0 109.477 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.5 ttt -62.78 -53.02 60.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -69.94 -41.82 74.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.914 -1.116 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.6 -47.57 83.2 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.078 -1.014 . . . . 0.0 109.855 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.8 m -62.26 -44.27 96.92 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.291 -0.881 . . . . 0.0 110.208 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.52 -48.12 50.8 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.055 -1.028 . . . . 0.0 110.548 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -62.78 -44.1 99.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.026 -1.046 . . . . 0.0 109.461 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.25 -35.33 80.13 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.176 -0.953 . . . . 0.0 110.01 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.43 -57.9 8.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.067 -1.021 . . . . 0.0 110.621 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.4 m -97.06 27.26 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 121.323 -0.861 . . . . 0.0 110.063 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -55.39 -32.78 62.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.961 -1.087 . . . . 0.0 110.08 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.671 ' HG3' HH11 ' A' ' 22' ' ' ARG . 9.4 mtt85 48.65 -94.93 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.973 -1.079 . . . . 0.0 110.096 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' N ' ' O ' ' A' ' 21' ' ' ALA . 67.8 t0 -62.69 -53.27 56.94 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.273 -0.892 . . . . 0.0 111.189 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.45 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 80.9 p -171.39 -160.24 0.17 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.199 -0.938 . . . . 0.0 109.567 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -50.21 -17.78 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -82.43 136.59 34.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.161 -1.2 . . . . 0.0 108.974 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.88 145.34 31.54 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.47 -0.769 . . . . 0.0 109.328 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.02 131.53 48.92 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.27 -0.894 . . . . 0.0 109.551 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 tp -57.2 -39.88 76.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.244 -0.91 . . . . 0.0 109.554 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -57.74 -41.4 81.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.112 -0.993 . . . . 0.0 109.201 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.373 -0.83 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.18 -48.46 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 109.477 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.66 -48.02 84.66 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.91 -43.85 97.69 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.291 -1.123 . . . . 0.0 109.638 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.539 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 87.6 t80 -60.35 -46.36 90.2 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.186 -0.946 . . . . 0.0 109.263 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.53 -38.92 92.99 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.42 -0.8 . . . . 0.0 109.173 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.34 -46.84 76.38 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.536 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -64.47 -44.17 91.87 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.897 . . . . 0.0 109.517 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.539 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.4 m-80 -65.4 -40.14 93.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.864 . . . . 0.0 110.362 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -90.76 167.15 16.97 Favored Pre-proline 0 N--CA 1.505 2.293 0 O-C-N 121.317 -0.865 . . . . 0.0 108.979 -179.265 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.08 -45.06 43.8 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.497 1.465 . . . . 0.0 111.252 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 t -179.03 88.67 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.426 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 36.4 t80 -61.38 174.4 0.73 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.336 -0.852 . . . . 0.0 109.05 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -133.4 76.18 68.43 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.485 -0.759 . . . . 0.0 110.15 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.56 -37.96 94.6 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.194 1.929 . . . . 0.0 111.932 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -60.65 -37.24 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.606 -0.684 . . . . 0.0 109.233 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -59.61 -40.02 86.15 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -82.55 31.47 0.41 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.378 -0.826 . . . . 0.0 108.993 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.92 169.75 4.98 Favored Glycine 0 N--CA 1.495 2.586 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -68.16 -39.42 82.62 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.462 -1.022 . . . . 0.0 109.652 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.6 8.51 2.57 Favored Glycine 0 N--CA 1.504 3.194 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -68.1 -12.27 60.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.169 -1.195 . . . . 0.0 108.639 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.79 -40.38 94.99 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.1 p -60.79 -36.95 80.28 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.349 -0.844 . . . . 0.0 109.032 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -69.37 -36.81 77.22 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.377 -0.827 . . . . 0.0 110.12 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.1 tpt -61.22 -47.81 84.41 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.897 -1.127 . . . . 0.0 109.871 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.45 -25.46 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.119 -0.988 . . . . 0.0 109.394 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -62.4 -32.55 73.39 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.374 -0.829 . . . . 0.0 109.513 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -64.04 -33.44 75.76 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.411 -0.806 . . . . 0.0 108.874 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.02 142.53 47.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.391 -0.818 . . . . 0.0 109.433 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.7 p-10 -90.62 -34.62 15.39 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.282 -0.886 . . . . 0.0 111.273 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.411 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 40.4 p90 -73.04 16.27 0.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.678 -1.264 . . . . 0.0 110.396 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.1 mt -134.06 127.2 31.73 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.1 m -95.16 134.8 37.49 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -118.04 131.27 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 121.608 -0.682 . . . . 0.0 109.468 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -140.24 137.42 34.25 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.461 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -94.57 134.78 36.76 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -0.793 . . . . 0.0 109.291 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.7 m -117.37 129.92 56.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.644 -0.66 . . . . 0.0 109.346 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.429 ' O ' ' ND2' ' A' ' 70' ' ' ASN . 3.4 ptp85 -75.11 138.44 42.08 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.775 -1.203 . . . . 0.0 109.735 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.429 ' ND2' ' O ' ' A' ' 69' ' ' ARG . 30.3 m120 -151.0 92.05 1.77 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.72 -140.71 48.05 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.8 p -84.43 -6.21 59.36 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.44 -1.035 . . . . 0.0 110.356 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -123.2 97.72 5.55 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.508 -0.745 . . . . 0.0 109.852 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.9 134.52 50.96 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -103.41 128.35 50.56 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.53 -0.731 . . . . 0.0 109.677 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.5 t -71.29 154.35 41.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.633 -0.667 . . . . 0.0 109.601 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -136.56 145.65 45.23 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.3 pt -132.35 157.1 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -143.51 147.54 34.64 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.483 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -82.79 119.24 24.1 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.483 ' N ' HD13 ' A' ' 80' ' ' LEU . 79.4 ttt-85 -57.32 126.71 28.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.24 -0.912 . . . . 0.0 109.765 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.61 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 26.7 t-80 -171.7 -179.32 2.47 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.61 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 95.2 m-20 53.69 32.05 13.92 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.526 -0.734 . . . . 0.0 109.837 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.91 9.08 54.79 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.48 ' N ' HD12 ' A' ' 85' ' ' LEU . 10.1 mp 53.67 177.86 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.152 -1.205 . . . . 0.0 109.119 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 87' ' ' HIS . 9.2 tm-20 -165.04 117.29 1.19 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.006 -1.058 . . . . 0.0 109.125 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.459 ' ND1' ' N ' ' A' ' 88' ' ' HIS . 63.3 t-80 55.66 165.92 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.489 0.662 . . . . 0.0 109.963 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.501 ' ND1' ' N ' ' A' ' 89' ' ' HIS . 62.3 t-80 -82.63 161.77 22.1 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.151 -0.968 . . . . 0.0 109.197 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.501 ' N ' ' ND1' ' A' ' 88' ' ' HIS . 36.5 p-80 -154.39 157.11 38.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.063 -1.023 . . . . 0.0 109.491 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -80.2 152.93 28.89 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.437 -0.79 . . . . 0.0 109.836 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 51.99 94.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.549 -0.719 . . . . 0.0 110.208 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 92' ' ' HIS . 46.9 p-80 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.614 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.547 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 1' ' ' MET . 34.7 Cg_exo -62.34 144.99 95.93 Favored 'Trans proline' 0 N--CA 1.5 1.863 0 C-N-CA 122.268 1.979 . . . . 0.0 112.293 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.0 p-80 -157.53 123.77 4.83 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -89.12 -10.64 46.53 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.03 -1.044 . . . . 0.0 109.189 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.76 123.38 17.82 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.086 -1.009 . . . . 0.0 108.873 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -134.87 27.56 3.58 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.558 -0.714 . . . . 0.0 109.144 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.55 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -68.18 -42.45 30.51 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.334 -0.854 . . . . 0.0 109.886 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 34.7 Cg_exo -61.52 138.79 78.07 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.217 1.945 . . . . 0.0 111.738 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 9' ' ' LEU . 3.6 mm? -64.96 -41.96 95.02 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.184 -0.948 . . . . 0.0 108.991 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -65.22 -45.64 83.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 109.86 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -64.64 -35.84 82.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.66 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.5 ttt -61.71 -61.43 2.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.29 -0.881 . . . . 0.0 109.852 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -66.86 -40.31 87.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.069 -1.019 . . . . 0.0 110.256 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.9 m -61.75 -46.07 91.21 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.774 -1.204 . . . . 0.0 109.883 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.5 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.039 -1.038 . . . . 0.0 109.966 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.72 -46.75 62.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.479 ' O ' ' N ' ' A' ' 21' ' ' ALA . 98.1 mt -62.56 -45.16 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 109.509 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -67.6 -32.51 73.3 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.093 -1.004 . . . . 0.0 109.093 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.08 -25.71 67.92 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.29 -0.882 . . . . 0.0 109.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.1 m -131.89 19.43 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.423 -0.798 . . . . 0.0 110.335 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.86 -24.75 66.16 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.887 -1.133 . . . . 0.0 108.893 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 51.81 178.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.472 -0.768 . . . . 0.0 110.267 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -68.73 -18.67 64.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.617 -0.677 . . . . 0.0 110.038 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.7 m -74.45 -6.11 46.42 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.901 -1.124 . . . . 0.0 109.469 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -52.51 1.97 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.5 m95 -61.73 178.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -1.13 . . . . 0.0 109.274 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.83 133.13 14.5 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -73.49 132.07 42.49 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.248 -0.907 . . . . 0.0 109.354 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 tp -54.76 -38.45 67.21 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.238 -0.914 . . . . 0.0 109.546 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -57.94 -44.9 87.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.908 -1.12 . . . . 0.0 109.34 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.07 -41.01 99.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.122 -0.986 . . . . 0.0 109.414 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 82.5 t -62.36 -48.14 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.33 -49.17 76.78 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.9 m -61.32 -43.01 99.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.133 -1.216 . . . . 0.0 109.813 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.566 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 69.6 t80 -60.79 -47.35 86.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.253 -0.905 . . . . 0.0 109.385 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 40' ' ' ASP . 80.5 mt -63.0 -40.74 98.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.114 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 41' ' ' PRO . . . -57.51 -48.22 79.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.116 -0.99 . . . . 0.0 109.247 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -61.76 -41.24 97.44 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.204 -0.935 . . . . 0.0 109.132 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.566 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.2 m-80 -80.23 -9.81 59.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.277 -0.889 . . . . 0.0 109.269 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.0 t0 -164.57 71.31 1.55 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.266 -0.896 . . . . 0.0 109.457 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.447 ' N ' ' O ' ' A' ' 37' ' ' ALA . 52.4 Cg_exo -57.14 -30.71 88.07 Favored 'Trans proline' 0 N--CA 1.498 1.788 0 C-N-CA 122.595 2.197 . . . . 0.0 111.489 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -57.11 -13.58 3.08 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.606 -0.684 . . . . 0.0 110.183 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -92.22 -55.51 3.4 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 t0 54.44 85.56 0.19 Allowed Pre-proline 0 N--CA 1.498 1.94 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -54.77 -49.15 17.72 Favored 'Trans proline' 0 N--CA 1.499 1.804 0 C-N-CA 122.328 2.019 . . . . 0.0 112.511 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.498 HH11 ' HG2' ' A' ' 46' ' ' ARG . 66.1 mtp85 -53.19 -52.97 57.11 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.446 -0.784 . . . . 0.0 109.36 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -66.57 -35.09 79.36 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 19.7 t90 -79.34 3.39 18.35 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.193 -0.942 . . . . 0.0 109.777 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.8 126.95 1.01 Allowed Glycine 0 N--CA 1.497 2.714 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -65.91 -45.35 82.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.091 -1.241 . . . . 0.0 109.068 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.8 1.91 0.72 Allowed Glycine 0 N--CA 1.5 2.938 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -66.03 -3.29 5.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.236 . . . . 0.0 109.278 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.2 tp -66.25 -41.6 89.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.122 -0.986 . . . . 0.0 108.668 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 t -59.8 -44.17 94.11 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.438 -0.789 . . . . 0.0 109.66 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -68.09 -30.47 69.65 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.221 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -63.36 -46.97 84.09 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.179 -0.95 . . . . 0.0 109.83 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 57' ' ' VAL . 17.1 m -71.75 -21.09 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.159 -0.963 . . . . 0.0 109.788 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -59.42 -31.99 69.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.147 -0.971 . . . . 0.0 109.557 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -73.47 -3.23 26.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.093 -1.004 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.7 mt -100.22 110.23 22.48 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.368 -0.833 . . . . 0.0 108.862 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.7 t0 -66.12 -37.36 85.53 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 111.523 -179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -71.48 20.03 0.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.727 -1.233 . . . . 0.0 110.981 -178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.2 mt -139.34 127.89 23.05 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.223 -0.923 . . . . 0.0 108.954 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.2 m -90.13 133.2 35.02 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.355 -0.84 . . . . 0.0 109.017 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -120.94 130.73 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.675 -0.641 . . . . 0.0 109.45 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -144.73 153.2 41.44 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.461 -0.774 . . . . 0.0 109.077 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -103.79 144.67 31.17 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.418 -0.801 . . . . 0.0 110.265 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 132.14 44.54 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.638 0.732 . . . . 0.0 109.273 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.668 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -70.21 131.59 44.45 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.542 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 39.7 t-20 -148.69 104.72 3.5 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 120.845 -1.159 . . . . 0.0 109.347 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.28 -140.84 45.45 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 32.1 t -85.22 -3.43 58.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.331 -1.099 . . . . 0.0 110.563 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -134.18 120.39 20.01 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.25 -0.906 . . . . 0.0 109.605 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.75 140.05 58.83 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.678 -0.809 . . . . 0.0 108.828 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.542 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.7 m-70 -102.46 124.32 47.8 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.3 p -71.44 156.63 39.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.491 -0.756 . . . . 0.0 109.035 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.45 149.3 39.07 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.9 pt -142.26 153.92 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.53 -0.731 . . . . 0.0 109.685 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -152.32 152.68 32.41 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.875 . . . . 0.0 108.801 178.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -69.74 135.08 49.33 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.438 ' N ' HD13 ' A' ' 80' ' ' LEU . 41.3 ttp180 -59.29 -46.57 88.2 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.225 -0.922 . . . . 0.0 109.825 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.606 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 0.7 OUTLIER -71.54 -137.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.114 -0.991 . . . . 0.0 109.048 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.606 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 96.4 m-20 50.79 -175.54 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.063 -1.023 . . . . 0.0 109.846 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.34 -159.5 51.56 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 85' ' ' LEU . 3.4 mm? 50.72 28.68 3.72 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 109.342 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.75 137.14 50.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.423 -0.798 . . . . 0.0 109.681 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -78.19 156.88 29.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.488 -0.758 . . . . 0.0 109.517 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -71.97 143.86 49.08 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.244 -0.91 . . . . 0.0 109.309 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -69.02 130.43 42.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.184 -0.948 . . . . 0.0 109.783 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -67.68 -36.2 80.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.478 -0.764 . . . . 0.0 109.85 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -50.75 145.54 6.83 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.329 -0.857 . . . . 0.0 110.383 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.467 179.896 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.531 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.7 mpt? . . . . . 0 N--CA 1.492 1.651 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -61.3 146.99 96.74 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.543 2.162 . . . . 0.0 112.327 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -87.94 117.58 26.9 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.258 -0.901 . . . . 0.0 108.913 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -80.12 138.11 36.86 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.101 -0.999 . . . . 0.0 109.502 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -58.87 95.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 109.093 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -80.3 -1.91 42.96 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.325 -0.86 . . . . 0.0 108.957 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -47.63 151.49 1.47 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.162 -0.962 . . . . 0.0 109.715 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -55.46 122.66 12.13 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.855 1.703 . . . . 0.0 112.05 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.06 -39.6 93.49 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.647 -0.658 . . . . 0.0 109.527 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -53.84 -48.37 70.01 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.349 -0.845 . . . . 0.0 109.831 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.01 -40.4 94.87 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.221 -0.924 . . . . 0.0 109.341 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.8 ttm -61.85 -51.53 67.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.099 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -70.29 -40.37 74.31 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -61.82 -48.36 80.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.11 -0.994 . . . . 0.0 109.705 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.3 m -62.57 -42.9 99.84 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.155 -0.966 . . . . 0.0 110.262 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.02 -48.29 58.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.035 -1.041 . . . . 0.0 111.034 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.435 ' O ' ' N ' ' A' ' 21' ' ' ALA . 95.3 mt -63.1 -45.35 98.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.093 -1.004 . . . . 0.0 109.789 -178.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.2 -34.24 77.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.706 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.05 -39.1 93.72 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 110.066 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' C ' ' H ' ' A' ' 22' ' ' ARG . 14.8 m -114.02 16.25 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 121.614 -0.679 . . . . 0.0 110.321 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -63.0 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.68 -1.263 . . . . 0.0 110.041 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.568 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.0 mtp180 -61.13 -142.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.028 -1.045 . . . . 0.0 109.912 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 54.12 -88.5 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.133 -0.979 . . . . 0.0 109.17 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' ARG . 88.5 p -160.58 72.31 0.46 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.74 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.14 -60.88 1.04 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -53.78 178.63 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.324 -1.104 . . . . 0.0 109.821 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -152.8 129.38 10.75 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.13 127.03 29.99 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.141 -0.974 . . . . 0.0 109.47 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.3 tp -57.45 -39.2 75.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.4 -0.812 . . . . 0.0 109.155 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.7 m -57.11 -42.05 80.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.0 109.262 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.51 91.35 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.143 -0.973 . . . . 0.0 109.322 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.9 -47.95 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.17 -0.956 . . . . 0.0 109.224 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.98 -49.79 69.11 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -62.22 -42.33 99.21 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -1.132 . . . . 0.0 109.611 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.3 t80 -60.75 -46.43 90.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.231 -0.918 . . . . 0.0 109.446 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 mt -63.15 -40.01 96.33 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.122 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 109.275 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.04 -43.13 96.46 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 109.595 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 82.9 m-20 -90.51 4.66 50.49 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.242 -0.911 . . . . 0.0 109.136 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 36' ' ' LEU . 21.8 t70 -168.23 77.24 0.85 Allowed Pre-proline 0 N--CA 1.489 1.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.44 -28.14 52.76 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.137 1.891 . . . . 0.0 111.331 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.1 t -63.32 -15.53 57.63 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.462 -0.773 . . . . 0.0 109.587 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -75.01 131.3 40.53 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.227 -0.921 . . . . 0.0 109.085 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 18.6 p30 -138.45 83.07 21.5 Favored Pre-proline 0 N--CA 1.5 2.059 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -58.7 -24.78 72.66 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.464 ' HE ' ' CD2' ' A' ' 50' ' ' HIS . 45.2 mmm-85 -67.42 -42.52 83.06 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.846 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -72.77 -12.13 60.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.291 -0.88 . . . . 0.0 109.153 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -81.7 -2.83 51.89 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.21 -0.931 . . . . 0.0 109.581 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.12 13.81 7.48 Favored Glycine 0 N--CA 1.508 3.484 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.464 ' CD2' ' HE ' ' A' ' 46' ' ' ARG . 17.0 m80 56.24 110.73 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.653 -0.91 . . . . 0.0 110.736 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.75 -6.47 12.35 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -66.93 -7.75 24.41 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.386 -1.067 . . . . 0.0 109.034 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.35 -42.79 99.68 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -62.44 -43.61 98.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 109.539 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 25.9 mp0 -71.54 -27.9 63.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.312 -0.868 . . . . 0.0 109.395 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 44.7 ttp -67.67 -47.12 70.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.096 -1.002 . . . . 0.0 109.804 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.4 m -72.69 -14.85 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.068 -1.02 . . . . 0.0 109.702 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.32 -26.82 65.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.425 -0.797 . . . . 0.0 109.83 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -80.59 -3.69 51.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.05 -1.031 . . . . 0.0 109.418 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -99.07 110.22 22.84 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 63' ' ' LEU . 92.2 m-20 -64.58 -39.02 92.99 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.403 -0.811 . . . . 0.0 111.325 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -70.27 21.16 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.718 -1.239 . . . . 0.0 111.199 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.8 mt -138.21 131.9 31.01 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.192 -0.942 . . . . 0.0 108.978 178.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 86.8 m -93.43 134.83 35.27 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.322 -0.861 . . . . 0.0 108.689 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.6 t -122.62 131.17 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.473 -0.767 . . . . 0.0 109.244 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.0 tt0 -150.68 153.68 36.05 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 67' ' ' GLU . 2.6 pm0 -149.92 154.22 37.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.292 -0.88 . . . . 0.0 109.066 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 70' ' ' ASN . 45.1 t -143.85 132.23 22.09 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.452 -0.78 . . . . 0.0 109.35 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.553 HH11 ' CG ' ' A' ' 69' ' ' ARG . 0.8 OUTLIER -64.55 84.0 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' SER . 98.2 m-20 -98.6 142.94 29.55 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.382 -0.824 . . . . 0.0 109.544 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.53 -142.78 42.72 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -100.72 9.6 42.23 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.671 -0.899 . . . . 0.0 109.585 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.442 ' O ' ' ND1' ' A' ' 75' ' ' HIS . 36.6 ttmt -138.16 139.1 39.21 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.34 -0.85 . . . . 0.0 109.971 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.3 tp -66.44 128.95 38.18 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.442 ' ND1' ' O ' ' A' ' 73' ' ' LYS . 64.6 m80 -108.24 104.66 14.11 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.7 m -85.31 150.14 24.97 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 77' ' ' GLU . 55.1 mp0 -144.79 149.26 35.17 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.367 -0.833 . . . . 0.0 108.951 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.8 pt -135.08 152.25 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.725 -0.609 . . . . 0.0 109.467 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -141.04 155.81 46.12 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.48 94.31 6.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.877 . . . . 0.0 108.886 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 37.01 53.7 1.16 Allowed 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.533 0.682 . . . . 0.0 111.03 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -86.78 66.81 9.62 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.817 -1.177 . . . . 0.0 108.645 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -83.62 114.43 21.54 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.77 146.96 2.25 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.5 mt -64.29 -41.76 96.73 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.275 -1.132 . . . . 0.0 109.166 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -170.71 -74.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.002 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -76.31 171.74 14.05 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.214 -0.929 . . . . 0.0 109.59 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -163.81 120.37 1.7 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.321 -0.862 . . . . 0.0 108.873 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.9 t60 50.41 82.49 0.05 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.286 -0.884 . . . . 0.0 109.896 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -73.45 138.32 45.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.49 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -71.63 141.27 49.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.243 -0.911 . . . . 0.0 109.794 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 50.4 p-80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.604 179.865 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.6 mtt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -60.82 145.41 99.04 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.471 2.114 . . . . 0.0 112.402 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -65.82 -45.5 82.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.305 -0.872 . . . . 0.0 109.713 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -78.92 137.06 37.46 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.248 -0.908 . . . . 0.0 109.834 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -94.09 114.5 26.66 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.373 -0.829 . . . . 0.0 109.093 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.05 31.4 1.44 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.123 -0.986 . . . . 0.0 108.511 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 m170 -54.11 152.34 11.14 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.263 -0.898 . . . . 0.0 109.269 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -44.85 129.87 9.78 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.651 1.567 . . . . 0.0 112.086 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.99 -41.77 95.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.493 -0.755 . . . . 0.0 109.361 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.467 ' NE2' ' C ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -56.33 -48.77 76.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.326 -0.859 . . . . 0.0 109.41 -179.815 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.01 -34.66 78.21 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttt -62.62 -52.56 62.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.301 -0.874 . . . . 0.0 110.328 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.45 -42.01 75.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.908 -1.12 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.0 m -61.63 -44.45 96.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.845 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.1 t -61.67 -45.02 95.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.087 -1.008 . . . . 0.0 110.218 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.3 -46.11 51.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.261 -0.899 . . . . 0.0 110.897 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.05 -45.55 98.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.165 -0.959 . . . . 0.0 109.902 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.22 -32.81 72.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.245 -0.909 . . . . 0.0 109.834 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.13 -40.25 94.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.255 -0.903 . . . . 0.0 110.391 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.477 ' C ' ' H ' ' A' ' 22' ' ' ARG . 10.6 m -100.05 6.31 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 O-C-N 121.253 -0.905 . . . . 0.0 109.742 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.0 8.5 0.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.032 -1.043 . . . . 0.0 109.461 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.477 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.5 mtp180 -61.83 -40.5 95.51 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.078 -1.014 . . . . 0.0 109.859 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.502 ' C ' ' HG ' ' A' ' 24' ' ' SER . 37.0 p-10 -73.89 121.43 20.93 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.076 -1.015 . . . . 0.0 109.549 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' C ' ' A' ' 23' ' ' ASP . 96.3 p 47.38 -91.78 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.389 -0.82 . . . . 0.0 110.445 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 23' ' ' ASP . . . -159.41 -59.04 0.01 OUTLIER Glycine 0 N--CA 1.494 2.558 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -55.27 -177.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.396 -1.061 . . . . 0.0 109.872 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.08 135.06 32.19 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.636 -0.665 . . . . 0.0 109.239 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -71.31 134.83 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.257 -0.902 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 tp -55.6 -40.86 72.6 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 109.287 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 t -59.57 -43.8 93.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.112 -0.992 . . . . 0.0 108.991 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.15 86.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.237 -0.914 . . . . 0.0 109.664 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 73.5 t -61.72 -48.86 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.09 -1.006 . . . . 0.0 109.132 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.15 92.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.465 ' HB2' HH21 ' A' ' 46' ' ' ARG . 7.4 t -61.68 -44.28 97.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.859 -1.377 . . . . 0.0 109.832 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.547 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 71.6 t80 -57.98 -43.91 86.83 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.247 -0.908 . . . . 0.0 109.409 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.3 -40.3 96.98 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.337 -0.852 . . . . 0.0 108.992 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.089 -1.007 . . . . 0.0 109.192 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -61.04 -42.52 98.63 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.303 -0.873 . . . . 0.0 109.497 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.547 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.1 m-80 -83.01 -6.07 59.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.275 -0.891 . . . . 0.0 108.714 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -153.69 74.01 6.51 Favored Pre-proline 0 N--CA 1.495 1.799 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.25 -35.31 73.51 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.288 1.992 . . . . 0.0 111.204 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.6 p -66.57 -10.98 50.88 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.539 -0.725 . . . . 0.0 109.415 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -88.36 148.32 24.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.277 -0.889 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -129.45 78.18 76.1 Favored Pre-proline 0 N--CA 1.502 2.145 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 49' ' ' GLY . 41.7 Cg_endo -78.21 -27.3 5.6 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.724 1.616 . . . . 0.0 110.83 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.465 HH21 ' HB2' ' A' ' 34' ' ' SER . 25.2 mmt180 -65.02 -45.25 86.3 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.439 -0.788 . . . . 0.0 109.192 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -48.6 -30.85 5.81 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.319 -0.863 . . . . 0.0 110.295 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 15.0 p-90 -135.62 25.19 3.42 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.252 -0.905 . . . . 0.0 109.829 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -87.43 -11.54 68.81 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -66.5 -40.74 89.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.006 -1.291 . . . . 0.0 109.425 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.646 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . -139.89 -147.94 5.11 Favored Glycine 0 N--CA 1.502 3.073 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.414 ' HG2' HH11 ' A' ' 52' ' ' ARG . 94.9 mtt-85 49.0 -74.84 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 CA-C-N 117.53 0.665 . . . . 0.0 110.535 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.646 ' N ' ' O ' ' A' ' 51' ' ' GLY . 64.7 tp -51.18 -41.67 60.36 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.098 -1.001 . . . . 0.0 108.571 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.1 p -63.98 -29.66 70.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.484 -0.76 . . . . 0.0 109.137 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -85.87 -29.3 23.8 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.265 -0.897 . . . . 0.0 109.562 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.7 mtt -63.61 -41.4 98.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.158 -0.964 . . . . 0.0 109.15 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.7 m -61.47 -41.42 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.242 -0.911 . . . . 0.0 108.93 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.65 -31.98 72.36 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.692 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -89.56 -2.38 58.32 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.109 -0.994 . . . . 0.0 110.417 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 62' ' ' PHE . 6.3 mt -88.09 5.4 41.32 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.203 -0.936 . . . . 0.0 109.196 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.509 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.6 t0 56.55 -75.77 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.781 -0.574 . . . . 0.0 111.793 178.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 60' ' ' LEU . 47.6 p90 -65.52 26.95 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.623 -1.298 . . . . 0.0 111.848 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 61' ' ' ASP . 1.2 mm? -124.86 126.81 46.15 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 120.948 -1.095 . . . . 0.0 108.351 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.1 m -88.45 141.93 28.13 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.54 131.14 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.503 -0.748 . . . . 0.0 109.371 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -145.53 155.3 42.99 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.8 mp0 -114.58 123.95 50.63 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 89.8 p -109.44 150.92 27.38 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 130.54 34.76 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.589 0.709 . . . . 0.0 109.367 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -152.1 112.81 4.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.414 -0.804 . . . . 0.0 109.263 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.41 -144.64 47.41 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.4 p -92.92 1.92 57.05 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.509 -0.994 . . . . 0.0 109.864 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -123.71 135.94 54.16 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.487 -0.758 . . . . 0.0 109.935 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 73.6 mt -75.41 132.42 40.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -104.89 117.03 33.02 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.569 -0.707 . . . . 0.0 109.114 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.0 t -68.12 139.28 56.17 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.371 -0.83 . . . . 0.0 109.476 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -126.26 143.74 51.04 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.9 pt -135.37 158.44 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.742 -0.599 . . . . 0.0 110.07 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -147.98 139.8 23.94 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.38 106.76 0.57 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.635 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -65.95 140.74 58.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 109.957 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -76.69 11.08 1.81 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.36 -0.838 . . . . 0.0 109.313 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' C ' ' H ' ' A' ' 85' ' ' LEU . 61.9 t0 55.6 35.28 24.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.592 -0.693 . . . . 0.0 109.787 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -75.79 31.85 1.25 Allowed Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.453 HD23 ' N ' ' A' ' 86' ' ' GLU . 2.3 tt -89.16 115.36 26.62 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.092 -1.24 . . . . 0.0 108.325 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.453 ' N ' HD23 ' A' ' 85' ' ' LEU . 79.0 tt0 51.51 96.88 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.244 -0.91 . . . . 0.0 110.086 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -72.43 138.99 47.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 109.565 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -73.91 141.63 46.0 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.315 -0.865 . . . . 0.0 109.17 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 80.6 m80 -73.64 140.97 46.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.142 -0.974 . . . . 0.0 109.644 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.99 137.95 45.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.327 -0.858 . . . . 0.0 110.001 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 48.51 74.86 0.16 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.442 -0.786 . . . . 0.0 110.481 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.447 ' OXT' ' CG ' ' A' ' 92' ' ' HIS . 56.9 t-80 . . . . . 0 N--CA 1.494 1.741 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.01 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.7 mtm . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -61.13 145.84 98.31 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.408 2.072 . . . . 0.0 112.039 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -122.33 145.32 48.37 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -72.14 138.71 47.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.344 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.5 tp10 -102.5 -23.35 13.91 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.6 mtmm -88.67 -6.25 57.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.09 -1.007 . . . . 0.0 109.014 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -171.46 77.08 0.51 Allowed Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 121.531 -0.73 . . . . 0.0 109.046 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.67 143.47 95.01 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.317 2.012 . . . . 0.0 112.192 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -63.8 -41.2 97.96 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.88 -39.6 81.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.259 -0.901 . . . . 0.0 109.255 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -61.82 -43.54 98.65 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.3 -0.875 . . . . 0.0 109.129 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.2 mtt -63.89 -46.76 83.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.208 -0.933 . . . . 0.0 109.868 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -69.74 -44.12 70.91 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.228 -0.92 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.6 m -63.28 -47.2 83.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.937 . . . . 0.0 110.147 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -66.5 -40.27 89.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 110.133 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.059 -1.026 . . . . 0.0 110.603 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -62.71 -44.45 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.349 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.73 -33.54 75.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 110.063 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 -58.92 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.134 -0.979 . . . . 0.0 110.467 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -98.31 29.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.314 -0.866 . . . . 0.0 109.453 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -48.91 -33.6 11.11 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.011 -1.056 . . . . 0.0 109.659 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.758 HH11 ' HG2' ' A' ' 22' ' ' ARG . 40.8 ttp85 51.92 -87.48 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.466 -0.771 . . . . 0.0 110.605 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 21' ' ' ALA . 95.9 m-20 -60.74 -88.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.892 -1.13 . . . . 0.0 109.989 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 26' ' ' TRP . 31.6 t -167.99 97.95 0.45 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.099 -1.001 . . . . 0.0 109.363 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.5 -25.69 2.38 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.402 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.2 m95 -91.51 142.69 27.38 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.209 -1.171 . . . . 0.0 109.607 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.48 141.7 29.75 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.305 -0.872 . . . . 0.0 108.945 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -67.54 130.36 42.8 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.291 -0.881 . . . . 0.0 109.728 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.72 -39.47 71.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.349 -0.844 . . . . 0.0 109.225 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 t -58.6 -44.0 89.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.098 -1.001 . . . . 0.0 109.173 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.32 87.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.154 -0.966 . . . . 0.0 109.684 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.09 -48.98 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.078 -1.014 . . . . 0.0 109.387 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.47 -44.39 97.73 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -69.64 -40.33 76.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 109.804 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -61.71 -48.52 80.39 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.249 -0.907 . . . . 0.0 109.637 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.0 mt -63.09 -42.14 99.55 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.232 -0.918 . . . . 0.0 108.954 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.64 87.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.907 . . . . 0.0 109.084 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -64.97 -42.85 94.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 109.383 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -84.78 -4.64 59.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.171 -0.955 . . . . 0.0 109.352 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 36' ' ' LEU . 7.9 m-20 -154.74 74.24 5.78 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.278 -0.889 . . . . 0.0 108.884 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.0 -35.18 80.09 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.377 2.051 . . . . 0.0 111.286 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.8 t -65.4 -12.47 52.58 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.47 136.12 56.75 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.301 -0.874 . . . . 0.0 108.784 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.438 ' O ' ' ND2' ' A' ' 47' ' ' ASN . 66.2 m-20 -120.45 92.26 47.41 Favored Pre-proline 0 N--CA 1.502 2.141 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.17 -8.31 21.85 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 121.175 1.25 . . . . 0.0 111.49 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.758 HH11 ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -66.85 -41.9 86.63 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.566 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.556 ' O ' ' NH2' ' A' ' 52' ' ' ARG . 17.1 p30 -70.48 -22.09 62.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.528 -0.733 . . . . 0.0 109.549 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.523 ' CE3' ' SD ' ' A' ' 56' ' ' MET . 89.7 m95 -93.61 3.81 54.93 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.131 -0.981 . . . . 0.0 109.112 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.35 138.74 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -68.22 -36.27 79.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.139 -1.212 . . . . 0.0 110.267 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.62 -34.83 5.87 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.556 ' NH2' ' O ' ' A' ' 47' ' ' ASN . 46.3 ttp180 -63.93 -17.51 63.31 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.547 -0.973 . . . . 0.0 109.247 -178.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.3 tp -62.9 -43.05 99.83 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -64.83 -27.6 68.99 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.499 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -80.86 -34.28 33.86 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.139 -0.976 . . . . 0.0 109.4 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.523 ' SD ' ' CE3' ' A' ' 48' ' ' TRP . 47.3 ttp -61.48 -45.75 92.93 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -60.94 -31.3 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.28 -0.888 . . . . 0.0 109.487 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -64.6 -30.65 71.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.349 -0.844 . . . . 0.0 109.896 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -86.94 -7.04 58.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.998 -1.064 . . . . 0.0 110.164 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.7 mt -101.36 127.08 48.16 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.322 -0.861 . . . . 0.0 109.051 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' CG ' ' A' ' 62' ' ' PHE . 97.3 m-20 -65.24 -168.91 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.244 -0.91 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CG ' ' O ' ' A' ' 61' ' ' ASP . 54.5 p90 42.89 16.51 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 122.028 -0.42 . . . . 0.0 111.427 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -132.83 116.37 16.44 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.247 -0.908 . . . . 0.0 108.792 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.407 ' N ' HD13 ' A' ' 63' ' ' LEU . 85.1 m -91.98 141.02 29.08 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.5 t -114.84 130.01 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-O 121.525 0.679 . . . . 0.0 109.621 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -154.23 143.74 21.51 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -108.92 152.25 25.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.646 -0.659 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.5 m -127.38 131.37 50.34 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.605 ' N ' ' HD3' ' A' ' 69' ' ' ARG . 0.1 OUTLIER -77.52 136.63 38.34 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.462 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -149.56 101.2 3.07 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.154 -0.966 . . . . 0.0 109.367 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.73 -141.77 47.81 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.0 p -86.97 -3.97 59.13 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.488 -1.007 . . . . 0.0 109.953 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.508 ' HD2' ' HE2' ' A' ' 75' ' ' HIS . 37.8 ttmt -115.71 121.81 43.62 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.675 -0.641 . . . . 0.0 110.143 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 tt -82.46 130.11 35.04 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.508 ' HE2' ' HD2' ' A' ' 73' ' ' LYS . 38.0 m80 -110.22 124.55 51.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.517 -0.739 . . . . 0.0 109.694 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.5 m -72.01 151.92 42.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.518 -0.739 . . . . 0.0 109.294 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -138.78 151.74 47.33 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.1 pt -137.17 156.45 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.623 0.725 . . . . 0.0 109.525 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -157.81 151.04 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.1 mt -70.33 139.52 52.03 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -68.67 89.89 0.39 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.221 -0.925 . . . . 0.0 109.935 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.473 ' O ' ' N ' ' A' ' 84' ' ' GLY . 86.5 t60 -157.6 159.07 36.68 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 108.812 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 52.15 -89.17 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.376 -0.828 . . . . 0.0 110.009 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 82' ' ' HIS . . . 79.72 -155.45 39.21 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.493 ' H ' HD23 ' A' ' 85' ' ' LEU . 0.2 OUTLIER -79.68 135.11 36.46 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.272 -1.134 . . . . 0.0 109.168 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -164.63 -32.11 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.202 -0.936 . . . . 0.0 109.061 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -81.1 -10.12 59.71 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.453 -0.78 . . . . 0.0 109.366 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.64 -39.44 84.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.475 -0.765 . . . . 0.0 109.398 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -54.28 -31.17 53.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.173 -0.954 . . . . 0.0 109.668 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -57.86 -43.33 85.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 109.465 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.12 -42.71 88.84 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.242 -0.911 . . . . 0.0 109.894 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 85.7 t60 . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 117.854 -1.07 . . . . 0.0 109.379 -179.507 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.563 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.731 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 1' ' ' MET . 31.6 Cg_exo -61.85 145.96 96.77 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.324 2.016 . . . . 0.0 112.21 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.472 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 57.8 t-80 52.0 47.5 24.63 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.313 -0.867 . . . . 0.0 110.322 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -154.51 41.75 0.48 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.18 -0.95 . . . . 0.0 109.278 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.31 140.52 55.95 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.941 . . . . 0.0 109.136 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt 49.94 -167.11 0.03 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.333 -0.855 . . . . 0.0 109.745 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.506 ' HE2' ' CE ' ' A' ' 12' ' ' MET . 61.4 t60 -152.3 70.58 7.59 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.869 . . . . 0.0 109.111 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.42 142.68 98.66 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.063 1.842 . . . . 0.0 111.752 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.23 -43.34 95.22 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.17 -0.956 . . . . 0.0 109.221 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -65.03 -45.36 85.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.39 -0.819 . . . . 0.0 109.4 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.49 -30.39 70.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.352 -0.842 . . . . 0.0 109.406 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.506 ' CE ' ' HE2' ' A' ' 7' ' ' HIS . 20.8 ttt -61.33 -66.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.307 -0.871 . . . . 0.0 109.803 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.32 -41.94 96.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.0 110.157 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.07 -46.32 89.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.963 -1.086 . . . . 0.0 109.862 -179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.4 m -61.27 -44.69 96.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.021 -1.049 . . . . 0.0 110.201 -179.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.29 -43.55 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.161 -0.962 . . . . 0.0 110.529 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.38 -45.21 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.195 -0.94 . . . . 0.0 109.677 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -67.91 -35.39 78.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.327 -0.858 . . . . 0.0 109.848 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.74 -38.31 90.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.193 -0.942 . . . . 0.0 110.113 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 22' ' ' ARG . 8.3 m -98.4 3.99 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 121.345 -0.847 . . . . 0.0 109.566 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 14.47 0.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.049 -1.032 . . . . 0.0 109.55 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 20' ' ' VAL . 7.2 mtp180 -46.85 164.41 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.143 -0.973 . . . . 0.0 110.684 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -48.66 96.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.574 0.702 . . . . 0.0 110.117 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.7 m -164.77 -70.67 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.362 -0.836 . . . . 0.0 108.87 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 159.52 120.58 0.57 Allowed Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 24.7 m95 45.87 -121.85 1.06 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.552 -0.97 . . . . 0.0 109.995 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -167.45 117.44 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.046 -1.034 . . . . 0.0 108.762 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.57 131.63 49.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.5 -38.28 66.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.4 -0.813 . . . . 0.0 109.448 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -58.48 -43.35 88.94 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.208 -0.932 . . . . 0.0 108.973 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.36 90.79 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.301 -0.875 . . . . 0.0 109.47 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.42 -49.4 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.158 -0.963 . . . . 0.0 109.217 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.41 -48.38 79.06 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.9 m -62.26 -43.18 99.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.298 -1.119 . . . . 0.0 109.85 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.472 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 66.6 t80 -61.29 -45.26 95.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.337 -0.852 . . . . 0.0 109.685 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.79 -41.14 97.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 109.293 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.19 82.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.245 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -65.39 -45.58 83.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -0.916 . . . . 0.0 109.809 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.472 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 3.0 m120 -64.6 -40.51 95.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.154 -0.966 . . . . 0.0 109.651 -179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -88.02 160.08 47.07 Favored Pre-proline 0 N--CA 1.501 2.101 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.394 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.41 -38.02 56.03 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.917 1.745 . . . . 0.0 111.416 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.4 m -170.36 76.88 0.08 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.247 -0.908 . . . . 0.0 109.437 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.5 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 37.4 t80 -59.58 169.56 1.28 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.298 -0.876 . . . . 0.0 109.498 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -127.19 76.05 76.53 Favored Pre-proline 0 N--CA 1.503 2.211 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -73.12 -24.02 17.52 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.556 1.504 . . . . 0.0 111.396 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.548 ' HG3' HH11 ' A' ' 46' ' ' ARG . 80.5 mtt85 -65.77 -38.77 89.95 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -61.24 -37.82 84.43 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.507 ' HA ' HH21 ' A' ' 52' ' ' ARG . 78.1 m95 -87.78 6.47 35.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.317 -0.864 . . . . 0.0 109.169 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.39 125.01 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -62.63 -12.67 24.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -1.142 . . . . 0.0 109.543 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . -113.87 -43.24 0.81 Allowed Glycine 0 N--CA 1.505 3.281 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.507 HH21 ' HA ' ' A' ' 48' ' ' TRP . 55.3 ttp85 -66.97 -11.47 56.83 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.567 -0.96 . . . . 0.0 108.882 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.66 -42.1 99.43 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.6 p -62.39 -39.08 92.06 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.381 -0.824 . . . . 0.0 109.086 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' O ' ' A' ' 51' ' ' GLY . 3.7 mp0 -72.72 -30.29 64.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.386 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.8 tpt -64.91 -47.43 77.81 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.973 -1.08 . . . . 0.0 109.503 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -72.93 -18.92 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 109.495 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -61.62 -28.79 69.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.456 -0.777 . . . . 0.0 109.789 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -74.52 -1.25 20.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.158 -0.964 . . . . 0.0 109.262 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.8 mt -100.87 119.35 38.55 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.461 -0.775 . . . . 0.0 108.999 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.1 p-10 -74.11 -36.77 64.25 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.234 -0.917 . . . . 0.0 111.417 -179.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -72.15 19.18 0.07 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.703 -1.248 . . . . 0.0 110.978 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.8 mt -136.72 129.59 30.79 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.205 179.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 87.6 m -88.51 133.37 34.17 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 108.778 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -125.72 132.81 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.527 -0.733 . . . . 0.0 109.608 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.548 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 3.3 pt20 -153.62 154.52 34.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -104.41 118.01 35.56 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.357 -0.839 . . . . 0.0 108.822 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 15.3 m -87.62 152.31 22.27 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.71 134.21 36.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.384 -0.822 . . . . 0.0 109.613 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.726 ' C ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -150.72 93.57 1.97 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.006 -1.059 . . . . 0.0 109.185 -179.667 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.54 -141.67 41.5 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.9 t -87.0 -7.7 57.9 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.29 -1.123 . . . . 0.0 109.895 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -106.34 127.88 53.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.404 -0.81 . . . . 0.0 109.742 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.7 mt -75.15 133.53 41.47 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.401 ' CD2' ' OD1' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -106.89 120.37 41.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -74.98 146.36 41.73 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.498 -0.751 . . . . 0.0 109.271 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.03 150.24 41.04 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.365 -0.834 . . . . 0.0 108.927 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.0 pt -140.0 157.22 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 121.467 0.651 . . . . 0.0 109.408 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -149.02 147.93 29.13 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 110.94 16.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.018 -1.051 . . . . 0.0 109.247 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -54.79 -93.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.57 -0.706 . . . . 0.0 109.848 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 82' ' ' HIS . 54.9 t-80 48.07 46.46 19.36 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -62.6 -123.76 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.529 -0.732 . . . . 0.0 109.684 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.57 10.4 86.23 Favored Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.3 mt -88.54 -2.23 58.48 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.301 -1.117 . . . . 0.0 109.001 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 59.51 146.69 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.637 0.732 . . . . 0.0 110.174 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -75.05 133.85 41.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.321 -0.862 . . . . 0.0 109.22 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -150.84 149.17 29.37 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.268 -0.895 . . . . 0.0 109.225 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -68.53 135.32 51.38 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.173 -0.954 . . . . 0.0 109.739 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -76.93 -8.73 57.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.501 -0.75 . . . . 0.0 109.567 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -71.44 141.27 50.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.287 -0.883 . . . . 0.0 109.986 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.557 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.433 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 10.5 ptp . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 1' ' ' MET . 32.6 Cg_endo -61.53 145.18 98.06 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 122.252 1.968 . . . . 0.0 112.074 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -71.28 132.09 44.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.572 -0.705 . . . . 0.0 109.814 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -166.87 -51.61 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.322 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -7.84 0.16 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.23 -0.919 . . . . 0.0 108.951 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.95 153.36 40.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.32 -0.862 . . . . 0.0 109.663 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 63.74 149.62 0.11 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.754 -0.591 . . . . 0.0 109.756 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -45.45 158.03 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.514 0 C-N-CA 121.62 1.546 . . . . 0.0 112.21 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.478 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.9 mp -62.09 -40.39 95.67 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -54.39 -41.52 69.33 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.25 -0.906 . . . . 0.0 109.294 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -63.32 -42.91 99.02 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.317 -0.864 . . . . 0.0 109.264 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.8 ttt -62.04 -52.21 64.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.009 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -69.14 -42.13 76.38 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.03 -1.043 . . . . 0.0 110.038 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.8 m -62.05 -45.66 92.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.217 -0.927 . . . . 0.0 109.844 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.5 m -60.74 -42.38 97.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 109.7 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.38 95.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 110.354 -179.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 21' ' ' ALA . 96.5 mt -61.93 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.887 -1.133 . . . . 0.0 109.474 -179.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.73 -34.92 78.91 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.198 -0.939 . . . . 0.0 109.565 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.69 -28.59 68.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.102 -0.998 . . . . 0.0 110.08 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 m -136.73 27.93 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.47 -0.769 . . . . 0.0 109.715 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -62.88 -23.26 67.25 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.839 -1.163 . . . . 0.0 109.025 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 55.52 -168.98 0.08 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.247 0.546 . . . . 0.0 110.378 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -58.92 -48.19 82.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.228 -0.92 . . . . 0.0 110.565 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 m -71.65 151.29 43.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.912 -1.117 . . . . 0.0 109.359 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.01 -0.9 66.42 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -100.27 147.66 25.52 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.64 -0.917 . . . . 0.0 109.508 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.0 126.43 39.53 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.481 ' HG3' ' H ' ' A' ' 31' ' ' ALA . 12.8 pt-20 -63.44 138.89 58.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.235 -0.916 . . . . 0.0 109.638 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.597 HD23 ' OG ' ' A' ' 76' ' ' SER . 0.1 OUTLIER -54.31 -38.42 65.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.455 -0.778 . . . . 0.0 109.241 -178.74 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.6 m -55.91 -44.46 78.27 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 109.628 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.481 ' H ' ' HG3' ' A' ' 28' ' ' GLU . . . -66.38 -38.95 88.69 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.136 -0.978 . . . . 0.0 109.552 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.8 -50.2 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.001 -1.062 . . . . 0.0 109.369 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.09 97.99 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -59.8 -44.21 94.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.179 -1.189 . . . . 0.0 109.493 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -60.97 -47.69 85.29 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.77 -39.67 94.82 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.388 -0.82 . . . . 0.0 109.021 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.7 -45.52 81.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.14 -0.975 . . . . 0.0 109.591 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.1 -48.54 81.29 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.233 -0.917 . . . . 0.0 109.345 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -65.96 -40.19 91.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.309 -0.87 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.03 151.08 75.69 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.223 -0.923 . . . . 0.0 109.185 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -62.3 -35.04 75.87 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.697 1.598 . . . . 0.0 111.57 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.6 m -171.58 80.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.747 -0.596 . . . . 0.0 109.394 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -88.37 -76.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 63.19 91.13 0.08 OUTLIER Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -62.48 -17.55 58.59 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.374 1.383 . . . . 0.0 111.375 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -56.89 -47.46 80.43 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.364 -0.835 . . . . 0.0 109.026 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' A' ' 49' ' ' GLY . 98.1 m-20 -62.12 -33.8 75.14 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 27.1 m95 -75.96 26.55 0.12 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.176 -0.953 . . . . 0.0 109.783 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 51' ' ' GLY . . . 69.45 95.82 0.05 OUTLIER Glycine 0 N--CA 1.492 2.429 0 C-N-CA 119.964 -1.112 . . . . 0.0 110.371 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 49.27 -90.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.41 -1.053 . . . . 0.0 110.457 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 49' ' ' GLY . . . -157.76 62.9 0.32 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -58.7 -5.7 0.62 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.405 -1.056 . . . . 0.0 109.053 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 53' ' ' LEU . 8.9 mp -62.59 -39.48 93.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.3 p -55.89 -33.27 64.46 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.527 -0.733 . . . . 0.0 109.795 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -85.54 -33.58 21.72 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 28.2 ttt -66.03 -43.79 86.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.098 -1.001 . . . . 0.0 109.816 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.62 -22.36 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.187 -0.945 . . . . 0.0 109.81 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -62.55 -21.91 65.93 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.489 -0.757 . . . . 0.0 109.202 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -86.21 6.64 28.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.284 -0.885 . . . . 0.0 109.79 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' PHE . 95.4 mt -93.59 -11.64 31.32 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.11 -0.993 . . . . 0.0 109.41 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 63' ' ' LEU . 22.9 t0 61.3 -61.56 0.09 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.804 -0.56 . . . . 0.0 111.778 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.497 ' N ' ' O ' ' A' ' 60' ' ' LEU . 49.2 p90 -65.82 22.03 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.66 -1.275 . . . . 0.0 112.138 -178.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 61' ' ' ASP . 7.6 mt -136.59 133.27 36.15 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.261 -0.899 . . . . 0.0 109.181 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.6 m -88.11 138.1 31.75 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.1 t -123.65 132.71 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -131.4 132.24 44.23 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -120.58 123.14 42.13 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -109.95 134.2 52.36 Favored 'General case' 0 N--CA 1.507 2.395 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.512 ' HG2' ' NH1' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -72.78 132.61 43.82 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.706 -1.246 . . . . 0.0 108.512 -179.121 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -148.85 91.24 1.84 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.186 -0.946 . . . . 0.0 109.041 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.02 -135.99 28.44 Favored Glycine 0 N--CA 1.489 2.188 0 N-CA-C 109.734 -1.347 . . . . 0.0 109.734 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 87.4 p -86.56 -4.36 59.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.32 -1.106 . . . . 0.0 110.355 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -132.05 136.02 46.92 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.369 -0.832 . . . . 0.0 108.972 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -88.46 158.39 18.37 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 179.74 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -98.07 103.98 15.97 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.121 -0.987 . . . . 0.0 108.691 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.597 ' OG ' HD23 ' A' ' 29' ' ' LEU . 9.2 t -76.92 150.73 35.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 109.226 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -148.1 137.65 22.3 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.063 -1.023 . . . . 0.0 108.545 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 38.3 pt -117.86 145.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 CA-C-O 121.582 0.706 . . . . 0.0 109.728 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -159.02 142.22 14.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.291 -0.88 . . . . 0.0 108.63 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 82' ' ' HIS . 44.8 mt -69.21 137.01 52.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 108.91 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -68.55 7.39 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.609 -0.682 . . . . 0.0 110.119 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 80' ' ' LEU . 84.4 t60 -56.51 -40.29 74.76 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 109.749 -179.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 83' ' ' ASP . 17.2 p-10 -82.81 8.51 12.13 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.259 -0.901 . . . . 0.0 109.765 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.47 166.15 4.52 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.09 -176.1 0.19 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -1.108 . . . . 0.0 109.609 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 53.99 31.66 13.96 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.666 -0.646 . . . . 0.0 109.671 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 87' ' ' HIS . 84.1 t60 -158.85 43.2 0.25 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.42 -0.8 . . . . 0.0 108.998 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -150.81 9.48 0.6 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.371 -0.831 . . . . 0.0 109.299 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -64.91 -40.0 94.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 109.49 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -67.47 154.32 41.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 110.084 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 52.38 86.47 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.534 -0.729 . . . . 0.0 110.297 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.5 m80 . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 117.965 -1.017 . . . . 0.0 109.913 179.647 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 mtt . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -44.25 135.41 8.63 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 121.474 1.449 . . . . 0.0 112.059 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -78.24 -93.2 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.278 -0.888 . . . . 0.0 109.521 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' C ' ' H ' ' A' ' 6' ' ' LYS . 70.9 mmtt -88.31 -152.29 0.22 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.319 -0.863 . . . . 0.0 109.25 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.413 ' O ' ' NE2' ' A' ' 7' ' ' HIS . 96.4 mt-10 -71.84 37.33 0.06 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 109.568 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' A' ' 4' ' ' LYS . 36.9 ttmt -78.21 -19.97 52.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.156 -0.965 . . . . 0.0 109.076 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' NE2' ' O ' ' A' ' 5' ' ' GLU . 16.1 m-70 63.7 150.51 0.11 Allowed Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.735 -0.603 . . . . 0.0 109.441 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -43.81 152.74 0.32 Allowed 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.804 1.669 . . . . 0.0 112.299 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.9 -40.99 99.26 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.432 -0.793 . . . . 0.0 109.231 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.8 -50.01 75.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -67.68 -30.85 70.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.869 . . . . 0.0 109.69 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 ttt -64.17 -63.97 1.01 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -63.06 -43.13 99.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.142 -0.974 . . . . 0.0 110.071 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.29 -45.87 91.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.4 m -61.93 -44.24 97.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.164 -0.96 . . . . 0.0 110.237 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.5 -46.2 60.37 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.999 -1.063 . . . . 0.0 110.857 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.48 -46.09 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.101 -0.999 . . . . 0.0 109.921 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -67.79 -36.17 79.95 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.362 -0.836 . . . . 0.0 109.671 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.56 93.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.125 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 m -99.55 -0.52 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.305 -0.872 . . . . 0.0 109.952 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.33 -47.17 86.43 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.031 -1.043 . . . . 0.0 108.613 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.413 ' C ' ' H ' ' A' ' 24' ' ' SER . 36.9 mtt180 48.57 34.81 5.28 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.761 0.791 . . . . 0.0 109.987 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 53.48 10.06 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.844 -0.535 . . . . 0.0 109.94 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 22' ' ' ARG . 85.9 p -79.36 165.77 22.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.27 -0.894 . . . . 0.0 109.602 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -56.52 110.33 2.02 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 38.3 m95 46.33 -163.56 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.569 -0.959 . . . . 0.0 110.424 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.82 133.79 40.16 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.53 -0.731 . . . . 0.0 109.179 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -69.15 133.86 48.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.914 . . . . 0.0 109.647 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 36.0 tp -58.38 -39.75 80.46 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.235 -0.916 . . . . 0.0 109.045 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -56.78 -41.3 77.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.254 -0.904 . . . . 0.0 109.257 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.68 88.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.264 -0.898 . . . . 0.0 109.576 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.3 -48.23 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.276 -0.89 . . . . 0.0 109.57 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.71 -46.85 93.37 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.3 m -62.76 -43.26 99.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.19 -1.183 . . . . 0.0 109.877 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.605 ' CE1' ' ND2' ' A' ' 39' ' ' ASN . 58.5 t80 -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 109.655 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.0 mt -63.03 -41.1 99.44 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.294 -0.879 . . . . 0.0 109.168 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.43 -42.67 74.51 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.103 -0.998 . . . . 0.0 109.246 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.93 -42.86 94.31 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.337 -0.852 . . . . 0.0 109.386 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.605 ' ND2' ' CE1' ' A' ' 35' ' ' TYR . 86.1 m-20 -88.9 6.5 38.95 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.325 -0.859 . . . . 0.0 109.492 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 36' ' ' LEU . 39.6 t0 -144.94 79.44 11.98 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.36 -0.837 . . . . 0.0 108.8 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -60.57 156.32 42.77 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.197 1.931 . . . . 0.0 111.865 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 p 70.43 -2.98 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.509 -0.744 . . . . 0.0 109.384 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -83.0 134.72 35.04 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.102 -0.999 . . . . 0.0 109.201 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.97 88.32 44.57 Favored Pre-proline 0 N--CA 1.502 2.129 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -54.24 -35.16 82.28 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 121.856 1.704 . . . . 0.0 110.633 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 47.7 mmm-85 -60.19 -36.93 78.74 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.071 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 49' ' ' GLY . 83.4 m-20 -63.3 -37.16 86.16 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.114 -0.991 . . . . 0.0 108.697 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -76.89 19.17 0.3 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.568 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 88.11 156.19 30.24 Favored Glycine 0 N--CA 1.501 2.97 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ARG . 58.6 t-80 -78.48 111.64 14.72 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.316 -1.108 . . . . 0.0 109.703 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 57.35 6.1 2.02 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' HIS . 40.2 ttp180 -65.46 -1.02 2.2 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.288 -1.125 . . . . 0.0 109.145 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.475 ' N ' HD12 ' A' ' 53' ' ' LEU . 10.3 mp -62.66 -38.67 91.22 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.7 p -55.24 -33.08 62.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -80.1 -35.96 36.1 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.049 -1.032 . . . . 0.0 109.379 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 tpt -65.42 -45.63 83.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.067 -1.02 . . . . 0.0 109.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.38 -23.86 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.066 -1.021 . . . . 0.0 109.662 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -67.43 -21.69 65.55 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.525 -0.734 . . . . 0.0 109.856 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -91.75 -8.22 47.46 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.072 -1.018 . . . . 0.0 110.543 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mt -94.19 -7.21 42.86 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.986 -1.071 . . . . 0.0 108.197 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 46.86 55.15 8.21 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.742 -0.598 . . . . 0.0 110.931 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -151.51 9.28 0.54 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.892 -1.13 . . . . 0.0 110.575 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mt -137.84 149.03 45.97 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 71.7 m -86.72 122.92 31.3 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.4 t -111.51 118.72 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -144.25 142.63 30.59 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -94.43 152.43 18.61 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.35 -0.844 . . . . 0.0 109.394 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 131.11 21.64 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -73.35 130.49 40.28 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -152.46 155.04 36.72 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 109.618 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.15 -131.18 51.92 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.1 m -113.76 8.68 17.51 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.843 -0.798 . . . . 0.0 109.588 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -147.57 153.56 39.59 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.995 . . . . 0.0 110.061 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.6 tp -63.43 136.95 57.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.486 -0.759 . . . . 0.0 109.237 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -121.88 134.55 54.87 Favored 'General case' 0 N--CA 1.505 2.299 0 CA-C-O 121.644 0.735 . . . . 0.0 109.231 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.4 p -77.86 158.01 29.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.523 -0.736 . . . . 0.0 109.28 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -144.9 144.59 31.17 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 pt -133.07 151.51 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.723 -0.611 . . . . 0.0 109.448 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -155.32 150.54 26.94 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.547 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -64.01 131.64 48.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.896 . . . . 0.0 108.609 -179.545 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.547 ' N ' HD13 ' A' ' 80' ' ' LEU . 12.0 ptp180 -73.95 38.6 0.11 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.02 -1.05 . . . . 0.0 109.941 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.598 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -78.34 -104.83 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.843 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.598 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 31.6 t70 -63.73 134.31 55.1 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.061 -1.024 . . . . 0.0 109.865 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 167.5 -52.94 0.23 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.3 tp -63.05 -51.31 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.114 -1.227 . . . . 0.0 109.214 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 40.98 -146.6 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.739 -0.601 . . . . 0.0 110.499 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 75.9 m80 50.85 16.9 0.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.918 -1.114 . . . . 0.0 110.203 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -65.38 -41.02 94.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -0.914 . . . . 0.0 109.17 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -71.26 -20.69 62.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.179 -0.951 . . . . 0.0 109.505 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.43 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 57.2 t-80 -73.99 44.0 0.17 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.352 -0.842 . . . . 0.0 109.458 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.16 -43.08 87.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.9 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.782 -179.705 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.9 mtt . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -61.22 146.5 97.38 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 122.403 2.069 . . . . 0.0 112.167 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -157.13 3.21 0.13 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.279 -0.888 . . . . 0.0 109.03 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.4 mttp 50.93 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.521 -0.737 . . . . 0.0 110.123 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -66.1 -37.24 85.27 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.238 -0.914 . . . . 0.0 109.723 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -91.79 144.09 25.86 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.294 -0.879 . . . . 0.0 109.244 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 52.24 89.12 0.1 Allowed Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 109.105 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -54.68 146.41 54.72 Favored 'Trans proline' 0 N--CA 1.499 1.811 0 C-N-CA 121.731 1.62 . . . . 0.0 112.135 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.23 -41.89 98.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.281 -0.887 . . . . 0.0 108.979 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -59.57 -39.84 85.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 0.0 109.088 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.17 -37.14 86.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.12 -0.988 . . . . 0.0 108.698 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 93.5 mtp -61.22 -48.01 83.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 109.841 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -68.97 -42.02 77.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.228 -0.92 . . . . 0.0 109.913 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 m -62.55 -50.11 72.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.015 -1.053 . . . . 0.0 110.009 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -66.37 -42.62 87.73 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.326 -0.859 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.1 65.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.154 -0.966 . . . . 0.0 111.526 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 93.0 mt -62.88 -44.61 99.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.838 -1.164 . . . . 0.0 109.584 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -66.37 -30.21 70.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.159 -0.963 . . . . 0.0 109.481 -179.897 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -48.48 75.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.132 -0.98 . . . . 0.0 110.721 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.46 18.01 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 121.352 -0.843 . . . . 0.0 109.841 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.507 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -60.45 -38.58 84.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 109.441 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 22' ' ' ARG . 32.6 mtm180 51.0 72.06 0.39 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 110.773 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 51.78 36.8 18.75 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.429 -0.794 . . . . 0.0 110.203 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.507 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 46.5 m -162.51 121.26 2.2 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.077 -1.014 . . . . 0.0 108.836 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.37 0.68 3.56 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.424 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.3 m95 -99.7 145.93 27.08 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.505 -0.997 . . . . 0.0 108.95 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.01 143.85 31.39 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 35.3 mp0 -68.72 132.39 46.75 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.003 -1.061 . . . . 0.0 109.369 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -55.09 -40.62 70.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.117 -0.989 . . . . 0.0 109.287 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -58.51 -43.76 89.24 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.249 -0.907 . . . . 0.0 108.909 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.03 -37.62 88.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.347 -0.845 . . . . 0.0 109.799 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.0 t -62.05 -49.5 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.11 -43.92 98.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.994 -1.243 . . . . 0.0 109.994 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.1 t -62.69 -45.18 93.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.001 -1.293 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 86.8 t80 -60.96 -48.48 81.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 109.499 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.71 -39.29 93.4 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.426 -0.796 . . . . 0.0 109.112 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.51 82.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.314 -0.866 . . . . 0.0 109.03 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.51 -44.15 91.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.639 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.8 m-80 -64.58 -40.33 95.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.279 -0.888 . . . . 0.0 110.371 -179.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.84 153.21 42.1 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.194 -0.941 . . . . 0.0 109.422 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -47.69 -43.72 27.87 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.19 1.26 . . . . 0.0 111.73 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.2 m -168.97 77.71 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.517 ' CG ' ' N ' ' A' ' 44' ' ' ASP . 45.6 t80 -60.03 -176.19 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.172 -0.955 . . . . 0.0 109.582 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.517 ' N ' ' CG ' ' A' ' 43' ' ' PHE . 3.6 m-20 -145.72 87.97 6.67 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -80.71 -92.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 121.646 1.564 . . . . 0.0 111.245 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.445 ' C ' ' H ' ' A' ' 48' ' ' TRP . 10.3 ptm180 -66.9 -22.3 65.97 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.005 -1.059 . . . . 0.0 109.898 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -51.14 -10.34 0.08 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.072 -1.017 . . . . 0.0 109.795 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.508 ' CD1' ' O ' ' A' ' 44' ' ' ASP . 10.1 m0 -76.59 -25.96 54.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.188 -0.945 . . . . 0.0 108.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 168.06 -168.17 40.62 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -74.45 76.79 1.92 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.391 -1.064 . . . . 0.0 109.787 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.03 17.98 79.18 Favored Glycine 0 N--CA 1.498 2.831 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.493 ' HG2' HH11 ' A' ' 52' ' ' ARG . 75.8 ttt-85 -62.51 -19.03 63.19 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.267 -1.137 . . . . 0.0 108.935 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.32 -44.14 97.18 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -63.03 -35.03 78.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.543 -0.723 . . . . 0.0 109.213 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -77.5 -29.19 52.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.31 -0.868 . . . . 0.0 109.5 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.3 ttp -62.9 -46.4 88.02 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.284 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.67 -30.07 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.196 -0.94 . . . . 0.0 109.554 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.3 -35.95 78.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.187 -0.946 . . . . 0.0 109.8 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -64.34 -35.43 80.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 108.874 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -75.48 138.87 41.88 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.672 -0.642 . . . . 0.0 109.281 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -87.57 -32.72 19.2 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.408 -0.808 . . . . 0.0 111.324 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -76.29 18.0 0.33 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.911 -1.118 . . . . 0.0 110.764 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.35 127.82 32.44 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.465 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 86.0 m -92.08 135.39 34.01 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.2 t -109.88 130.94 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.483 -0.76 . . . . 0.0 109.146 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -153.4 157.12 39.48 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 67' ' ' GLU . 2.0 pm0 -145.86 155.81 43.13 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.051 -1.031 . . . . 0.0 108.558 -179.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 66.1 m -132.4 147.62 52.39 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.685 ' HG3' HH11 ' A' ' 69' ' ' ARG . 9.0 mtm-85 -76.52 140.91 41.34 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.394 0.616 . . . . 0.0 109.79 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -150.94 100.71 2.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.442 -0.786 . . . . 0.0 109.684 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 64.61 -139.09 40.89 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.3 p -89.29 4.62 48.21 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.398 -1.06 . . . . 0.0 109.868 -179.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -139.38 114.64 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.468 -0.77 . . . . 0.0 109.542 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -76.06 141.29 42.09 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -102.92 123.07 45.85 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.545 -0.722 . . . . 0.0 109.434 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.8 m -71.18 149.8 45.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.472 -0.768 . . . . 0.0 109.057 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -139.64 153.42 47.31 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 pt -141.39 156.45 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt-85 -137.84 147.96 45.0 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.26 117.9 29.35 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 83' ' ' ASP . 92.6 mtt-85 -64.22 -41.03 97.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 110.184 -178.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.2 t-80 61.81 -72.86 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 81' ' ' ARG . 93.1 m-20 -53.64 -90.27 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.309 -0.869 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 80.33 17.33 74.14 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.465 HD22 ' N ' ' A' ' 85' ' ' LEU . 4.1 mm? -86.1 -1.9 57.83 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.354 -1.086 . . . . 0.0 108.761 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.19 127.84 33.48 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.847 . . . . 0.0 109.49 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -80.38 164.05 23.39 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.404 -0.81 . . . . 0.0 109.471 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -150.7 145.76 26.02 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.152 -0.968 . . . . 0.0 108.984 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -87.74 132.24 34.21 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.081 -1.012 . . . . 0.0 109.704 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -66.61 -37.62 85.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.469 -0.77 . . . . 0.0 109.491 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -62.45 -40.51 96.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 84.6 t60 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.89 -1.052 . . . . 0.0 109.507 -179.591 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.9 mtm . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.0 148.52 92.56 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.659 2.239 . . . . 0.0 112.146 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -60.89 -41.52 96.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 108.953 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -157.52 56.93 0.5 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.256 -0.903 . . . . 0.0 109.117 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 48.58 89.26 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.158 -0.964 . . . . 0.0 109.965 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -90.77 31.83 1.03 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.113 -0.992 . . . . 0.0 109.994 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.539 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -73.28 -43.26 7.3 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 109.506 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 22.1 Cg_exo -62.45 143.39 93.24 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 122.144 1.896 . . . . 0.0 112.145 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -65.26 -42.02 93.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.383 -0.823 . . . . 0.0 109.233 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.28 -43.75 97.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 109.607 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.26 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' HD22 ' A' ' 36' ' ' LEU . 39.8 tpp -61.58 -53.84 51.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.294 -0.879 . . . . 0.0 109.814 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -70.16 -40.66 74.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.193 -0.942 . . . . 0.0 109.999 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -62.63 -45.55 92.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.068 -1.02 . . . . 0.0 109.661 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -60.17 -45.03 94.46 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.202 -0.936 . . . . 0.0 110.07 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.46 -48.06 43.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.232 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.57 -44.61 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.126 -0.983 . . . . 0.0 109.475 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -66.27 -33.51 75.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.209 -0.932 . . . . 0.0 109.889 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.38 -59.15 3.63 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.182 -0.949 . . . . 0.0 110.706 -179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -96.72 29.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.345 -0.847 . . . . 0.0 109.918 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.75 -20.49 2.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.974 -1.079 . . . . 0.0 109.97 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.639 ' HG3' HH11 ' A' ' 22' ' ' ARG . 3.7 ttt85 60.21 43.4 13.98 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.594 -0.691 . . . . 0.0 109.24 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 41.58 37.49 0.72 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.782 -0.574 . . . . 0.0 111.192 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.6 p -143.82 9.32 1.53 Allowed 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.173 -0.954 . . . . 0.0 109.39 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.87 -43.73 0.98 Allowed Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.437 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 99.4 m95 -75.17 174.87 8.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.3 -1.117 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.35 145.43 22.75 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -71.28 127.44 32.56 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.468 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.03 -42.21 68.89 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.125 -0.984 . . . . 0.0 109.512 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -60.13 -43.29 95.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.227 -0.921 . . . . 0.0 109.069 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.02 81.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.75 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.79 -49.04 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.965 -1.084 . . . . 0.0 109.6 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.66 -49.56 77.3 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.3 m -64.98 -42.22 94.74 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.288 -1.125 . . . . 0.0 110.017 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -60.56 -49.3 78.08 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.258 -0.901 . . . . 0.0 109.558 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.486 ' O ' ' N ' ' A' ' 40' ' ' ASP . 91.6 mt -63.1 -41.95 99.48 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.299 -0.876 . . . . 0.0 109.029 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.62 86.88 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.885 . . . . 0.0 109.288 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.5 -42.89 95.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.435 -0.79 . . . . 0.0 109.678 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -85.14 -2.93 58.58 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.226 -0.921 . . . . 0.0 109.531 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 36' ' ' LEU . 23.9 t70 -161.14 75.79 2.5 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.83 -27.34 52.53 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.141 1.894 . . . . 0.0 111.071 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 m -66.37 -8.21 24.08 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.566 -0.709 . . . . 0.0 109.397 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -69.31 134.23 48.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.352 -0.842 . . . . 0.0 109.254 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -117.85 91.04 38.16 Favored Pre-proline 0 N--CA 1.504 2.239 0 O-C-N 121.815 -0.553 . . . . 0.0 109.85 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.04 -17.34 30.85 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.148 1.899 . . . . 0.0 111.021 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 46' ' ' ARG . 78.4 mtt180 -63.98 -35.63 81.32 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.613 0.72 . . . . 0.0 109.229 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -61.36 -36.1 79.26 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CD1' ' N ' ' A' ' 48' ' ' TRP . 48.4 m95 -77.99 3.59 14.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 50' ' ' HIS . . . 70.36 -1.71 18.58 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' ARG . 72.9 t60 59.1 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.822 -0.81 . . . . 0.0 109.923 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.505 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 68.91 -65.24 0.48 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.536 ' HG3' HH11 ' A' ' 52' ' ' ARG . 85.2 mtm-85 -59.58 2.45 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.68 -0.894 . . . . 0.0 109.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 51' ' ' GLY . 59.1 tp -57.77 -41.04 81.18 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.984 -1.073 . . . . 0.0 108.511 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -60.93 -41.97 97.25 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 108.946 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.9 mm-40 -71.52 -30.22 65.68 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.874 -1.141 . . . . 0.0 109.796 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.9 mmm -63.17 -42.99 99.49 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.873 -1.142 . . . . 0.0 109.544 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.0 m -73.55 -22.92 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.089 -1.007 . . . . 0.0 109.734 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -61.92 -39.08 90.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.046 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -98.2 56.77 1.21 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.371 -0.83 . . . . 0.0 110.003 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 mt -146.14 -6.32 0.57 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.508 ' O ' ' N ' ' A' ' 63' ' ' LEU . 23.0 t70 62.68 -174.15 0.15 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.344 -0.847 . . . . 0.0 110.134 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.488 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 31.1 p90 40.72 20.05 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.592 0 CA-C-O 121.295 0.569 . . . . 0.0 110.904 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.3 mt -141.97 131.63 24.07 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.214 -0.929 . . . . 0.0 109.472 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 81' ' ' ARG . 98.5 m -101.37 134.57 44.25 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.78 131.95 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 O-C-N 121.671 -0.643 . . . . 0.0 109.439 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.437 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 88.8 mt-30 -137.65 149.62 46.73 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -140.21 136.23 33.19 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.0 p -132.88 152.46 51.86 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.54 ' HG2' ' NH1' ' A' ' 69' ' ' ARG . 2.8 mtt-85 -89.11 130.66 35.52 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 75' ' ' HIS . 14.4 p-10 -150.31 114.45 5.11 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.019 -1.051 . . . . 0.0 109.619 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.4 -137.16 34.84 Favored Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.3 p -93.47 -0.95 56.21 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.314 -1.109 . . . . 0.0 110.248 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 68.5 mttm -134.81 139.35 45.03 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.376 -0.828 . . . . 0.0 109.684 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.65 151.08 37.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.232 -0.918 . . . . 0.0 109.077 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.47 ' CG ' ' OE2' ' A' ' 77' ' ' GLU . 19.5 t-160 -100.25 100.9 11.78 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.7 p -83.92 151.91 24.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.432 -0.793 . . . . 0.0 108.901 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.472 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 53.9 mp0 -146.44 153.59 40.63 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 pt -133.16 150.82 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 CA-C-O 121.398 0.618 . . . . 0.0 109.746 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -151.72 154.17 35.79 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 81' ' ' ARG . 60.4 mt -64.03 153.29 37.82 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.579 -0.701 . . . . 0.0 109.401 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 80' ' ' LEU . 9.0 tpp180 85.18 155.45 0.09 Allowed 'General case' 0 N--CA 1.509 2.512 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.466 ' H ' ' CD2' ' A' ' 82' ' ' HIS . 15.5 p80 -81.55 -30.29 33.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.244 -0.91 . . . . 0.0 109.074 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -166.95 -53.97 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.202 -0.936 . . . . 0.0 109.267 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.54 -28.22 8.63 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.465 HD22 ' N ' ' A' ' 85' ' ' LEU . 4.0 mm? -78.75 145.39 34.46 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.209 -1.171 . . . . 0.0 109.689 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 57.38 109.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.61 0.719 . . . . 0.0 109.97 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -151.69 165.53 34.1 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 47.3 m170 51.98 -159.31 0.11 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.391 -0.818 . . . . 0.0 109.699 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 51.4 85.8 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.443 -0.786 . . . . 0.0 109.976 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -77.46 151.3 34.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.411 -0.805 . . . . 0.0 109.714 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -146.22 15.71 1.33 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.375 -0.828 . . . . 0.0 109.383 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 73.7 m80 . . . . . 0 N--CA 1.497 1.881 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.132 -179.912 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.5 ptt? . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.41 158.4 55.47 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.339 2.026 . . . . 0.0 112.07 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' O ' ' A' ' 4' ' ' LYS . 77.1 m80 -59.62 -36.47 76.39 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.322 -0.861 . . . . 0.0 109.971 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 3' ' ' HIS . 17.8 ttmm 55.45 108.82 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.708 0.766 . . . . 0.0 110.157 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -149.84 45.57 0.93 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.237 -0.914 . . . . 0.0 109.029 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.1 -43.67 97.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.329 -0.857 . . . . 0.0 109.698 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m80 -98.63 151.75 37.58 Favored Pre-proline 0 N--CA 1.501 2.109 0 O-C-N 121.49 -0.757 . . . . 0.0 109.107 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -46.06 139.03 12.06 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.713 1.608 . . . . 0.0 112.221 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.488 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.2 mp -63.08 -41.6 99.45 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.326 -0.859 . . . . 0.0 108.798 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -57.96 -38.51 76.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 109.153 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -63.09 -42.13 99.55 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.17 -0.956 . . . . 0.0 109.451 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.5 mmm -63.5 -47.41 81.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.677 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -72.65 -43.86 62.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.094 -1.003 . . . . 0.0 110.163 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.54 -50.14 72.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.122 -0.986 . . . . 0.0 110.331 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.3 m -64.84 -42.33 94.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.37 -0.831 . . . . 0.0 110.254 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.18 48.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.54 -44.29 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 109.861 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -65.43 -33.82 76.84 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.73 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -39.43 93.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.012 . . . . 0.0 110.027 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.29 16.91 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.448 -0.782 . . . . 0.0 110.038 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.1 11.41 9.78 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.966 -1.084 . . . . 0.0 108.774 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.467 ' N ' ' HD3' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -46.71 143.53 2.72 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.382 -0.823 . . . . 0.0 110.7 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 t0 56.05 24.66 8.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.848 -0.533 . . . . 0.0 110.169 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.0 m 51.65 -153.53 0.19 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.976 -1.078 . . . . 0.0 109.921 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.82 56.57 4.07 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.491 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 36.6 m95 42.57 -139.48 0.18 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.779 -0.836 . . . . 0.0 110.624 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.71 138.52 11.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.022 -1.048 . . . . 0.0 108.692 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.87 125.37 28.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.127 -0.983 . . . . 0.0 109.286 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -54.29 -39.27 66.79 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.346 -0.846 . . . . 0.0 109.104 -178.201 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.1 t -59.94 -43.94 94.68 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.777 -1.202 . . . . 0.0 108.885 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.29 -40.7 94.17 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.0 t -63.47 -51.0 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.132 -0.98 . . . . 0.0 109.678 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.67 -41.85 99.77 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.21 -44.43 96.59 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.15 -1.206 . . . . 0.0 109.694 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.559 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 76.9 t80 -57.45 -43.34 83.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 109.353 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.0 mt -63.29 -38.16 90.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.916 . . . . 0.0 108.93 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.69 -46.69 70.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.009 -1.057 . . . . 0.0 109.708 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -63.37 -40.17 96.52 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.081 -1.012 . . . . 0.0 109.174 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.559 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 80.1 m-20 -90.46 7.2 40.02 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.074 -1.016 . . . . 0.0 109.297 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.2 t0 -164.71 57.83 0.56 Allowed Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 108.884 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 43' ' ' PHE . 27.7 Cg_endo -60.9 174.09 1.93 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 122.091 1.86 . . . . 0.0 111.947 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 m 66.36 -6.61 0.48 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' A' ' 41' ' ' PRO . 47.8 t80 -94.41 -74.44 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.093 -1.004 . . . . 0.0 108.665 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.1 t0 63.91 91.51 0.08 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.432 ' O ' ' N ' ' A' ' 49' ' ' GLY . 51.2 Cg_exo -54.02 -38.32 86.78 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.84 1.694 . . . . 0.0 111.653 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -55.43 -39.11 69.86 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.602 -0.686 . . . . 0.0 109.916 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -49.8 -44.25 49.01 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.924 -1.11 . . . . 0.0 110.454 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.456 ' NE1' ' CZ ' ' A' ' 43' ' ' PHE . 49.0 p-90 -116.22 16.25 15.88 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.521 -0.737 . . . . 0.0 109.222 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -161.38 62.53 0.28 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.485 ' C ' ' H ' ' A' ' 52' ' ' ARG . 49.9 t-80 -69.27 98.9 1.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.515 -0.991 . . . . 0.0 109.1 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.84 -38.92 0.24 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.049 -1.221 . . . . 0.0 110.049 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 50' ' ' HIS . 83.6 mtm-85 -66.9 -1.62 4.22 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -1.178 . . . . 0.0 109.442 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.32 -42.18 99.16 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.9 p -62.05 -27.48 68.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.24 -0.912 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -81.87 -34.88 29.84 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -62.44 -41.07 98.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.248 -0.908 . . . . 0.0 109.53 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.83 -9.07 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.384 -0.822 . . . . 0.0 109.766 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -58.75 -30.76 67.75 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.158 -0.963 . . . . 0.0 109.698 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.22 -7.63 48.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.068 -1.02 . . . . 0.0 108.984 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.9 mt -93.82 110.63 22.27 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.96 -1.088 . . . . 0.0 108.891 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.445 ' C ' ' H ' ' A' ' 63' ' ' LEU . 67.1 t0 -65.09 -37.84 88.82 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.345 -0.847 . . . . 0.0 111.133 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -70.98 20.18 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.772 -1.205 . . . . 0.0 111.262 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 61' ' ' ASP . 10.5 mt -138.07 125.64 22.12 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.222 -0.924 . . . . 0.0 108.839 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 84.0 m -87.8 142.44 27.81 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.397 -0.814 . . . . 0.0 108.883 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.6 t -117.17 129.53 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.491 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 49.3 tt0 -155.9 155.93 33.72 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 67' ' ' GLU . 1.8 pm0 -144.94 146.42 31.97 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.117 -0.989 . . . . 0.0 110.199 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.1 m -167.23 152.39 7.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.311 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.53 170.63 4.08 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.59 167.77 17.8 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 122.198 0.999 . . . . 0.0 111.056 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.69 -150.3 42.47 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.9 p -96.44 6.92 47.75 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.47 -1.018 . . . . 0.0 109.271 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -87.77 150.62 23.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.079 -1.013 . . . . 0.0 109.504 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -123.86 122.9 39.21 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -91.13 137.19 32.56 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.327 -0.858 . . . . 0.0 108.907 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 m -71.21 140.89 50.62 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.811 -1.181 . . . . 0.0 109.13 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -149.87 136.43 19.17 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.271 -0.893 . . . . 0.0 109.144 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 O-C-N 121.339 -0.851 . . . . 0.0 109.8 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -144.32 145.95 32.3 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.532 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -74.17 138.66 43.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.28 -0.887 . . . . 0.0 108.947 -179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.532 ' H ' HD13 ' A' ' 80' ' ' LEU . 12.7 tpt180 -65.94 3.59 0.79 Allowed 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.756 -179.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.46 ' CG ' HD12 ' A' ' 80' ' ' LEU . 9.2 m-70 -84.59 12.93 6.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.891 -1.131 . . . . 0.0 109.323 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -81.14 -0.9 42.26 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.311 -0.868 . . . . 0.0 109.747 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.17 -173.09 49.97 Favored Glycine 0 N--CA 1.499 2.855 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -153.88 5.51 0.3 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.312 -1.111 . . . . 0.0 108.956 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.447 ' N ' HD12 ' A' ' 85' ' ' LEU . 79.3 tt0 -53.43 91.26 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.301 -0.874 . . . . 0.0 110.107 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 85' ' ' LEU . 46.2 p-80 -79.71 -16.66 55.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.342 -0.849 . . . . 0.0 109.156 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -73.56 111.02 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.914 . . . . 0.0 109.049 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 54.0 m170 -83.67 147.44 27.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.279 -0.888 . . . . 0.0 109.953 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -71.46 124.06 23.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.329 -0.857 . . . . 0.0 109.58 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 p-80 -79.99 148.88 30.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.263 -0.898 . . . . 0.0 109.762 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.423 179.837 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.508 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -61.91 145.95 96.65 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.534 2.156 . . . . 0.0 112.17 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -159.85 -39.91 0.05 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.314 -0.866 . . . . 0.0 109.406 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.7 pttt -160.7 57.88 0.32 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.2 -0.938 . . . . 0.0 109.616 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -53.58 165.28 0.42 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.15 -0.969 . . . . 0.0 109.537 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -96.98 0.02 48.16 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.188 -0.945 . . . . 0.0 110.183 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.52 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -84.18 -43.65 0.75 Allowed Pre-proline 0 N--CA 1.503 2.179 0 O-C-N 120.98 -1.075 . . . . 0.0 110.027 -179.588 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 16.2 Cg_exo -66.13 140.73 60.62 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.346 2.03 . . . . 0.0 111.928 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.511 ' N ' HD12 ' A' ' 9' ' ' LEU . 9.9 mp -64.79 -43.59 92.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.148 -0.97 . . . . 0.0 109.346 179.511 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -63.48 -46.86 84.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.124 -0.985 . . . . 0.0 110.056 -179.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.82 -34.87 79.15 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.163 -0.96 . . . . 0.0 109.608 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.7 ttt -60.9 -51.98 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.142 -0.974 . . . . 0.0 109.982 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -69.7 -39.73 76.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.999 -1.063 . . . . 0.0 109.748 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.8 m -60.4 -45.24 94.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.025 -1.047 . . . . 0.0 109.641 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.3 p -61.94 -42.95 99.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.212 -0.93 . . . . 0.0 110.12 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.85 -46.05 55.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.061 -1.024 . . . . 0.0 110.843 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.49 -46.6 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.046 -1.034 . . . . 0.0 109.723 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -67.83 -34.19 76.24 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 109.843 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.84 92.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.334 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -100.46 5.74 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.317 -0.865 . . . . 0.0 109.702 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -67.14 -7.7 25.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.013 -1.054 . . . . 0.0 108.877 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -61.91 81.38 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.218 -0.926 . . . . 0.0 109.933 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 21' ' ' ALA . 34.7 t70 -173.54 -50.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.0 t -168.87 -30.69 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.772 . . . . 0.0 109.505 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.38 -64.08 0.33 Allowed Glycine 0 N--CA 1.498 2.809 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -54.28 -174.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -1.137 . . . . 0.0 110.166 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.3 136.64 14.03 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.375 -0.828 . . . . 0.0 108.86 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 56.5 mp0 -73.78 132.03 42.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.286 -0.884 . . . . 0.0 109.684 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.24 -40.81 74.73 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.329 -0.857 . . . . 0.0 109.172 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -57.09 -42.92 81.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.036 -1.04 . . . . 0.0 109.111 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.32 90.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 92.9 t -63.13 -48.84 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 109.542 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.73 97.32 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -68.39 -42.01 79.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -1.179 . . . . 0.0 109.892 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 67.7 t80 -61.64 -47.9 83.31 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.152 -0.967 . . . . 0.0 109.57 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.08 -40.82 98.8 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.236 -0.915 . . . . 0.0 108.753 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.34 77.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.104 -0.998 . . . . 0.0 109.512 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -61.63 -46.43 89.85 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.992 -1.068 . . . . 0.0 109.371 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.537 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.7 m-80 -65.15 -39.29 92.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -0.922 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.45 82.99 44.57 Favored Pre-proline 0 N--CA 1.502 2.128 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.27 -29.69 68.45 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.382 2.055 . . . . 0.0 111.1 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 m -67.63 -7.91 30.38 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.544 -0.723 . . . . 0.0 109.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -88.96 123.07 32.96 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.383 -0.823 . . . . 0.0 108.785 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -124.93 82.26 61.29 Favored Pre-proline 0 N--CA 1.502 2.153 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.505 ' O ' ' N ' ' A' ' 49' ' ' GLY . 34.1 Cg_endo -75.59 -33.64 3.89 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 C-N-CA 121.579 1.519 . . . . 0.0 110.947 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.605 ' HG3' HH11 ' A' ' 46' ' ' ARG . 80.6 mtt85 -62.85 -43.61 98.34 Favored 'General case' 0 N--CA 1.492 1.656 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -48.22 -31.53 5.93 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -178.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.8 p-90 -133.42 24.81 4.12 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -169.87 55.9 0.2 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -60.32 -47.2 87.03 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.359 -1.083 . . . . 0.0 109.48 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.51 -29.57 0.42 Allowed Glycine 0 N--CA 1.504 3.193 0 N-CA-C 109.112 -1.595 . . . . 0.0 109.112 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -5.1 2.66 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.369 -1.077 . . . . 0.0 109.177 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.27 -39.47 93.01 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 0.0 108.796 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.4 t -59.22 -39.9 84.15 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.366 -0.834 . . . . 0.0 109.371 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -75.83 -26.85 57.57 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.089 -1.007 . . . . 0.0 109.886 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.4 mmt -64.73 -43.21 94.11 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.775 -1.203 . . . . 0.0 109.633 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.413 HG22 ' H ' ' A' ' 57' ' ' VAL . 15.9 m -69.99 -22.39 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.236 -0.915 . . . . 0.0 109.62 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -62.69 -30.8 71.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 109.355 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -63.22 -34.25 77.25 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.206 -0.934 . . . . 0.0 109.272 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.97 116.05 14.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.356 -0.84 . . . . 0.0 109.334 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.453 ' C ' ' H ' ' A' ' 63' ' ' LEU . 90.0 m-20 -64.57 -40.78 96.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.538 -0.726 . . . . 0.0 111.596 -178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -70.57 19.03 0.05 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.634 -1.291 . . . . 0.0 111.349 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.453 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.9 mt -136.39 122.25 19.97 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.33 -0.856 . . . . 0.0 109.05 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 97.5 m -91.55 137.65 32.2 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.63 128.23 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.617 -0.677 . . . . 0.0 109.835 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -145.06 146.42 31.85 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 55.4 mp0 -95.92 148.49 22.57 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -127.82 140.23 52.16 Favored 'General case' 0 N--CA 1.503 2.197 0 CA-C-O 121.677 0.751 . . . . 0.0 109.498 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.646 HH11 ' HG2' ' A' ' 69' ' ' ARG . 3.3 mmt-85 -77.01 131.54 38.51 Favored 'General case' 0 N--CA 1.497 1.897 0 CA-C-O 121.42 0.629 . . . . 0.0 109.796 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -149.01 101.51 3.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.537 -0.727 . . . . 0.0 110.298 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 59.03 -142.62 46.35 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.8 t -85.68 1.46 49.28 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -1.202 . . . . 0.0 110.15 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -139.04 117.11 11.73 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.359 -0.838 . . . . 0.0 109.564 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -73.97 174.1 9.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.508 -0.745 . . . . 0.0 109.033 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -144.24 137.67 27.47 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.206 -0.934 . . . . 0.0 109.574 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.2 t -70.22 150.41 46.46 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.488 -0.757 . . . . 0.0 109.402 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -134.94 150.81 50.44 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 pt -132.72 152.61 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -149.96 152.49 35.04 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.04 109.26 14.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.161 -0.962 . . . . 0.0 109.043 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -69.18 -14.83 63.21 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.47 -0.769 . . . . 0.0 110.016 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 82.2 t60 54.22 80.79 0.11 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -76.95 -1.54 29.18 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.49 -80.4 0.06 OUTLIER Glycine 0 N--CA 1.495 2.626 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.9 mt 52.61 -120.24 1.65 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.375 -1.073 . . . . 0.0 109.779 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -78.92 -6.95 57.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.115 -0.99 . . . . 0.0 109.826 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 49.73 92.39 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.224 -0.922 . . . . 0.0 110.306 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 41.8 t-80 -167.84 87.23 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.4 -0.812 . . . . 0.0 109.443 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -151.4 142.81 23.46 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.1 -1.0 . . . . 0.0 109.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -90.84 118.29 30.13 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.336 -0.853 . . . . 0.0 109.63 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -66.48 -43.88 84.22 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.283 -0.886 . . . . 0.0 109.939 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.3 m80 . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.457 -179.803 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.75 152.89 79.67 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 122.057 1.838 . . . . 0.0 112.09 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -152.88 150.84 29.72 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.476 -0.765 . . . . 0.0 109.307 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -88.06 1.12 55.01 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.324 -0.86 . . . . 0.0 109.796 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -55.76 -173.51 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.078 -1.014 . . . . 0.0 109.366 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -71.34 119.52 15.59 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.641 ' H ' ' CD2' ' A' ' 7' ' ' HIS . 0.2 OUTLIER -74.37 178.67 1.57 Allowed Pre-proline 0 N--CA 1.499 2.001 0 O-C-N 121.372 -0.83 . . . . 0.0 109.091 -179.071 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 144.62 98.91 Favored 'Trans proline' 0 N--CA 1.499 1.845 0 C-N-CA 121.854 1.703 . . . . 0.0 111.882 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.6 mt -63.99 -42.13 97.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.432 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -64.79 -45.91 84.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.882 . . . . 0.0 109.594 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -66.11 -27.16 67.84 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.271 -0.893 . . . . 0.0 109.15 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.474 ' SD ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -67.5 -63.73 1.0 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.474 -0.766 . . . . 0.0 110.309 -179.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -61.89 -45.81 92.11 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.213 -0.929 . . . . 0.0 110.542 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.3 p -59.81 -44.06 94.19 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.995 -1.066 . . . . 0.0 110.408 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 t -61.11 -46.07 92.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.914 -1.117 . . . . 0.0 110.145 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.97 -48.39 45.31 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.386 -0.822 . . . . 0.0 110.837 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.417 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 91.5 mt -61.57 -48.07 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.132 -0.98 . . . . 0.0 109.711 -178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -66.91 -25.12 66.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 109.546 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.94 -32.73 51.68 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.024 -1.048 . . . . 0.0 110.564 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ARG . 5.9 m -108.32 -0.41 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.959 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -71.82 16.08 0.13 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.915 -1.116 . . . . 0.0 109.081 179.317 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.8 mtp180 -48.77 -13.02 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.881 -1.137 . . . . 0.0 110.422 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 21' ' ' ALA . 25.6 p30 -74.22 -5.89 44.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.241 -0.912 . . . . 0.0 109.339 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p 68.8 40.45 1.73 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.475 -0.766 . . . . 0.0 109.194 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.74 -140.37 4.12 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -54.63 -170.33 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.902 . . . . 0.0 110.064 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.28 139.76 20.52 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.221 -0.924 . . . . 0.0 108.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -69.93 128.04 34.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 109.343 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.5 -39.27 83.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.427 -0.795 . . . . 0.0 109.186 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.0 m -55.68 -43.82 76.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.921 -1.112 . . . . 0.0 109.402 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.93 -37.88 89.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.319 -0.863 . . . . 0.0 109.205 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 75.7 t -62.92 -48.55 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.219 -0.925 . . . . 0.0 109.74 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.19 -44.93 97.03 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 t -62.98 -45.06 94.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.222 -1.164 . . . . 0.0 109.953 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.419 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.0 t80 -61.04 -48.77 80.21 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.985 -1.072 . . . . 0.0 109.438 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 40' ' ' ASP . 93.0 mt -65.01 -41.18 95.56 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.216 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.36 -45.69 80.36 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.871 -1.143 . . . . 0.0 109.631 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -64.65 -42.3 95.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -0.884 . . . . 0.0 110.095 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.419 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 89.5 m-20 -86.67 -4.56 59.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.08 -1.013 . . . . 0.0 109.689 -179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 36' ' ' LEU . 16.4 m-20 -154.48 63.76 4.22 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.428 ' C ' ' H ' ' A' ' 43' ' ' PHE . 13.6 Cg_endo -54.76 -166.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.739 1.626 . . . . 0.0 111.859 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t 69.36 -6.24 1.0 Allowed 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -178.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 41' ' ' PRO . 1.6 t80 -77.51 135.68 38.25 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.234 -0.916 . . . . 0.0 108.661 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -123.82 84.6 54.1 Favored Pre-proline 0 N--CA 1.503 2.218 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -62.56 -25.35 75.55 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 121.905 1.737 . . . . 0.0 110.649 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 48' ' ' TRP . 47.7 mmm-85 -66.57 -37.74 85.59 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.951 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -55.55 -7.6 0.28 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.444 -0.785 . . . . 0.0 110.052 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.416 ' H ' ' C ' ' A' ' 46' ' ' ARG . 65.3 m95 -97.27 -15.79 20.64 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.136 -0.977 . . . . 0.0 109.613 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 48' ' ' TRP . . . 49.76 101.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.643 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 82.1 t60 51.03 84.4 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.096 -1.237 . . . . 0.0 110.469 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 159.33 -57.36 0.33 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 45.4 mtm180 48.29 -133.19 1.39 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.487 -1.008 . . . . 0.0 110.225 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 53' ' ' LEU . 10.3 mp -63.78 -36.57 84.34 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -49.57 -31.2 9.97 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.554 -0.716 . . . . 0.0 109.377 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -82.69 -40.66 20.33 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 33.6 tpp -62.4 -46.99 86.09 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.191 -0.943 . . . . 0.0 109.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.6 m -64.64 -35.37 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.082 -1.011 . . . . 0.0 109.615 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -57.45 -42.64 82.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 -179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -67.24 -44.37 79.62 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.025 -1.047 . . . . 0.0 109.262 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.3 mt -75.56 143.26 42.51 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.444 -0.785 . . . . 0.0 109.94 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 63' ' ' LEU . 71.4 m-20 -92.85 -150.86 0.28 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.335 -0.853 . . . . 0.0 109.913 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 54.4 p90 42.45 19.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.527 -0.733 . . . . 0.0 111.17 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 61' ' ' ASP . 15.7 mt -132.52 130.07 39.93 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.567 -0.708 . . . . 0.0 109.543 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 88.7 m -89.38 134.63 33.99 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 53.3 t -120.19 130.55 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.317 0 O-C-N 121.553 -0.717 . . . . 0.0 109.109 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -151.25 118.73 6.04 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -124.25 135.73 53.62 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.661 0.743 . . . . 0.0 109.705 -178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.7 t -100.23 125.23 46.38 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 mtt180 -68.73 135.59 51.52 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.026 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -150.0 103.89 3.24 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.483 -0.761 . . . . 0.0 109.737 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.74 -142.49 43.56 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 33.3 t -84.74 -9.03 58.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.284 -1.127 . . . . 0.0 110.247 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -121.45 116.55 24.95 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -89.7 151.17 21.99 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.955 -1.09 . . . . 0.0 108.519 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -99.77 99.95 10.84 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.364 -0.835 . . . . 0.0 109.066 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.5 t -75.37 146.58 40.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.407 -0.808 . . . . 0.0 109.217 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -142.75 143.64 32.31 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.9 pt -133.63 155.65 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-O 121.48 0.657 . . . . 0.0 109.77 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt85 -150.23 150.73 31.97 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.502 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -72.53 121.62 19.97 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.502 ' N ' HD13 ' A' ' 80' ' ' LEU . 7.7 tpt180 -54.67 135.37 46.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.451 -0.78 . . . . 0.0 110.268 -178.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.471 ' O ' ' ND1' ' A' ' 82' ' ' HIS . 9.9 p80 -57.09 92.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.244 -0.91 . . . . 0.0 108.665 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.43 ' N ' ' O ' ' A' ' 81' ' ' ARG . 97.7 m-20 -83.7 112.53 20.14 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.203 -0.936 . . . . 0.0 109.2 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 178.83 -150.34 9.5 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.407 HD23 ' C ' ' A' ' 85' ' ' LEU . 2.1 tt 58.16 94.92 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.372 -1.075 . . . . 0.0 108.982 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -98.56 55.94 1.1 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.403 -0.811 . . . . 0.0 109.637 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 64.1 t-80 52.12 77.95 0.14 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.419 -0.801 . . . . 0.0 110.451 179.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -74.88 149.53 39.49 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.314 -0.866 . . . . 0.0 109.15 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -154.1 148.61 26.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.029 -1.045 . . . . 0.0 109.52 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -148.06 142.34 26.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.36 -0.838 . . . . 0.0 109.429 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.3 m80 48.37 85.7 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.367 -0.833 . . . . 0.0 110.189 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.551 -179.887 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.54 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 37.9 Cg_exo -60.69 126.68 20.41 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.05 1.834 . . . . 0.0 111.826 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.6 mp -65.32 -42.26 93.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.197 -0.94 . . . . 0.0 109.366 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -55.18 -53.05 60.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.285 -0.884 . . . . 0.0 110.151 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -67.06 -39.44 86.88 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.117 -0.989 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 49.1 ttp -61.09 -50.09 74.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.249 -0.907 . . . . 0.0 110.045 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -67.47 -38.32 84.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.974 -1.079 . . . . 0.0 109.316 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -46.52 89.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.052 -1.03 . . . . 0.0 109.788 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.4 m -62.38 -43.13 99.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 110.399 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.76 -43.1 84.97 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.022 -1.049 . . . . 0.0 110.613 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.95 -44.83 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 109.609 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -67.26 -34.07 76.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.36 -0.837 . . . . 0.0 109.763 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.57 94.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.354 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.88 7.19 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.317 -0.864 . . . . 0.0 110.183 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -7.11 15.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.928 -1.107 . . . . 0.0 109.695 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.717 ' HG2' HH11 ' A' ' 22' ' ' ARG . 12.1 mtp85 -71.2 -19.93 62.33 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.31 -0.869 . . . . 0.0 108.883 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -61.34 -50.96 70.83 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.206 -0.934 . . . . 0.0 109.481 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 26' ' ' TRP . 2.5 m -179.78 77.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.544 -0.722 . . . . 0.0 109.263 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.0 -91.14 0.02 OUTLIER Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' A' ' 24' ' ' SER . 70.2 m95 -54.7 -174.07 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.444 -1.033 . . . . 0.0 109.985 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.04 134.29 29.57 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.661 -0.649 . . . . 0.0 109.343 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.36 134.63 48.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.342 -0.849 . . . . 0.0 109.335 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.56 -40.58 75.41 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 109.405 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 t -59.34 -43.14 92.8 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.108 -0.995 . . . . 0.0 109.161 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.22 88.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.252 -0.905 . . . . 0.0 109.617 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.45 -46.95 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.242 -0.911 . . . . 0.0 109.363 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.15 81.74 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.9 m -62.45 -42.57 99.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.162 -1.199 . . . . 0.0 109.688 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.546 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 67.8 t80 -60.75 -48.6 81.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.857 . . . . 0.0 109.387 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.16 -39.08 93.26 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 108.984 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.37 -48.56 80.21 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.99 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -73.15 -51.2 18.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.106 -0.996 . . . . 0.0 110.411 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.546 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 68.8 m-80 -65.43 -39.97 92.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.265 -0.897 . . . . 0.0 109.808 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -123.86 84.66 54.21 Favored Pre-proline 0 N--CA 1.502 2.138 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.32 -28.46 62.76 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.997 1.798 . . . . 0.0 111.333 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.1 p -67.54 -11.83 58.93 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.492 -0.755 . . . . 0.0 109.618 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -75.73 122.63 24.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.12 -0.987 . . . . 0.0 109.122 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -119.58 90.12 42.31 Favored Pre-proline 0 N--CA 1.505 2.278 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -63.28 -20.35 70.34 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.811 1.674 . . . . 0.0 110.776 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -62.71 -38.89 92.25 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.31 -37.97 85.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.296 -0.878 . . . . 0.0 108.725 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.526 ' CD2' ' SD ' ' A' ' 56' ' ' MET . 97.4 m95 -83.95 9.78 11.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.241 -0.912 . . . . 0.0 109.336 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 69.17 151.46 0.45 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.41 ' C ' ' H ' ' A' ' 52' ' ' ARG . 86.7 t60 -79.15 147.69 32.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.354 -1.086 . . . . 0.0 109.549 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.13 -40.01 0.7 Allowed Glycine 0 N--CA 1.494 2.513 0 N-CA-C 110.222 -1.151 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' H ' ' C ' ' A' ' 50' ' ' HIS . 89.4 mtt180 -67.44 -4.89 12.52 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.125 -1.221 . . . . 0.0 108.933 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.66 -40.8 98.2 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -60.53 -42.81 97.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.333 -0.855 . . . . 0.0 109.282 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.406 ' CD ' ' N ' ' A' ' 55' ' ' GLN . 21.8 mp0 -69.15 -27.12 65.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.86 . . . . 0.0 109.565 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.526 ' SD ' ' CD2' ' A' ' 48' ' ' TRP . 46.6 ttp -63.93 -48.73 75.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.932 -1.105 . . . . 0.0 109.481 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.8 m -69.16 -23.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.276 -0.89 . . . . 0.0 109.612 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.8 -28.62 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.485 -0.759 . . . . 0.0 109.378 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -77.49 -4.13 43.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.96 . . . . 0.0 109.567 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.92 109.82 22.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.352 -0.843 . . . . 0.0 108.984 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.449 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.4 m-20 -64.52 -39.37 93.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.495 -0.753 . . . . 0.0 111.192 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -70.29 19.29 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.851 -1.156 . . . . 0.0 111.288 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.449 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.7 mt -138.15 126.61 23.33 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.26 -0.9 . . . . 0.0 108.857 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 43.2 m -88.59 130.97 35.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.6 t -115.6 130.67 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 121.574 -0.704 . . . . 0.0 109.356 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.413 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -142.3 153.72 44.12 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.462 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.3 mp0 -107.46 119.11 38.51 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.4 m -85.49 155.86 21.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.216 -0.927 . . . . 0.0 108.511 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.83 83.17 4.75 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.543 ' ND2' ' CE1' ' A' ' 75' ' ' HIS . 52.6 t-20 -94.0 104.92 16.95 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.417 -0.802 . . . . 0.0 109.502 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.17 -142.09 44.92 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.62 -6.39 58.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.405 -1.056 . . . . 0.0 109.745 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -106.07 142.08 36.37 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.528 -0.732 . . . . 0.0 109.685 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.2 mt -91.6 123.39 34.97 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.543 ' CE1' ' ND2' ' A' ' 70' ' ' ASN . 48.2 m170 -101.9 135.63 43.12 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.605 -0.684 . . . . 0.0 109.299 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.1 m -79.24 148.48 32.19 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.412 -0.805 . . . . 0.0 109.133 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.6 mp0 -137.34 155.02 49.9 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.6 pt -134.48 153.6 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.734 -0.603 . . . . 0.0 109.386 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -143.58 148.77 36.4 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -85.76 120.46 27.21 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.743 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.492 ' N ' HD13 ' A' ' 80' ' ' LEU . 20.6 mmt85 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.442 -0.786 . . . . 0.0 110.314 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -45.83 138.8 11.48 Favored 'Trans proline' 0 N--CA 1.495 1.568 0 C-N-CA 121.701 1.601 . . . . 0.0 112.066 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.95 -41.48 97.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.409 -0.807 . . . . 0.0 109.436 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -57.77 -46.02 85.14 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.387 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.1 -39.1 93.32 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.214 -0.929 . . . . 0.0 109.344 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.73 -52.58 62.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 110.011 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.96 -41.6 74.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.936 -1.102 . . . . 0.0 109.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -60.5 -44.91 95.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.477 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 m -62.33 -42.22 99.2 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.71 79.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -63.05 -44.81 99.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.129 -0.982 . . . . 0.0 109.404 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.14 -32.04 72.88 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.391 -0.818 . . . . 0.0 109.721 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.89 94.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.0 110.72 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 m -124.12 28.76 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.687 0 O-C-N 121.43 -0.794 . . . . 0.0 110.55 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.91 -34.13 62.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.844 -1.16 . . . . 0.0 110.086 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 23' ' ' ASP . 35.8 mtm-85 44.95 77.14 0.08 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.241 -0.912 . . . . 0.0 109.741 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 22' ' ' ARG . 83.9 m-20 57.69 150.39 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.946 0.879 . . . . 0.0 111.014 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.8 m 57.98 157.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.503 -0.748 . . . . 0.0 110.229 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.73 0.22 86.6 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.12 144.69 27.38 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.313 -1.11 . . . . 0.0 109.587 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.75 139.12 29.27 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.457 -0.777 . . . . 0.0 108.93 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.07 131.22 45.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.165 -0.959 . . . . 0.0 109.745 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.13 -37.5 74.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.509 -0.744 . . . . 0.0 109.589 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -57.19 -44.01 83.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.149 -0.969 . . . . 0.0 109.203 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.9 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.211 -0.931 . . . . 0.0 109.271 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.69 -48.32 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.285 -0.884 . . . . 0.0 109.355 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.38 86.56 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 m -62.94 -42.29 99.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.163 -1.198 . . . . 0.0 109.529 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.551 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 76.8 t80 -60.7 -47.09 87.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.352 -0.843 . . . . 0.0 109.476 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.4 mt -62.51 -42.09 99.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.086 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.66 -42.61 79.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.061 -1.025 . . . . 0.0 109.495 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.31 -42.19 96.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.15 -0.969 . . . . 0.0 109.561 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.551 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 81.0 m-20 -90.09 5.14 48.04 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.193 -0.942 . . . . 0.0 109.287 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 36' ' ' LEU . 49.2 t0 -162.7 73.13 2.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.34 -15.82 49.4 Favored 'Trans proline' 0 N--CA 1.489 1.262 0 C-N-CA 121.226 1.284 . . . . 0.0 111.006 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.1 m -74.49 -7.87 54.45 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -74.75 136.36 41.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.475 -0.765 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.12 92.67 45.78 Favored Pre-proline 0 N--CA 1.506 2.33 0 O-C-N 121.949 -0.469 . . . . 0.0 110.151 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -64.01 -16.31 54.16 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 122.061 1.841 . . . . 0.0 111.882 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.58 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 5.3 mpt_? -64.49 -39.88 94.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -63.48 -37.49 87.5 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -92.85 22.62 4.71 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.282 -0.886 . . . . 0.0 108.742 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.31 160.53 3.15 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -77.99 -18.5 55.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.345 -1.091 . . . . 0.0 109.57 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.43 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -135.83 -19.25 0.73 Allowed Glycine 0 N--CA 1.505 3.244 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -67.88 2.89 1.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.11 -1.229 . . . . 0.0 109.122 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 51' ' ' GLY . 64.4 tp -62.43 -38.35 89.39 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -58.95 -42.56 90.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.17 -0.956 . . . . 0.0 109.145 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -66.17 -30.37 70.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.534 -0.729 . . . . 0.0 109.775 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.7 75.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.856 -1.152 . . . . 0.0 110.046 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 57' ' ' VAL . 17.1 m -71.12 -17.96 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.246 -0.909 . . . . 0.0 109.801 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.67 -29.21 69.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.359 -0.838 . . . . 0.0 109.369 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.03 -32.22 73.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 63.3 mt -71.93 112.8 8.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 109.228 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.3 m-20 -64.4 -40.89 96.68 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.5 -0.75 . . . . 0.0 111.387 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -69.78 20.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.727 -1.233 . . . . 0.0 111.347 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.8 mt -137.82 133.48 34.02 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.222 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.474 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 89.2 m -97.58 135.28 39.63 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -118.11 132.92 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -134.87 117.86 16.33 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -97.65 119.35 36.06 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.548 -0.72 . . . . 0.0 109.191 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.6 m -102.67 122.29 44.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.571 -0.706 . . . . 0.0 109.357 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 133.49 43.77 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.987 -1.07 . . . . 0.0 109.227 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.1 t-20 -149.89 95.68 2.34 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.561 -0.712 . . . . 0.0 109.482 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 62.99 -139.47 44.78 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 t -83.85 -7.33 59.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.403 -1.057 . . . . 0.0 110.387 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -125.59 123.4 38.96 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.504 -0.748 . . . . 0.0 109.293 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -87.06 153.97 21.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.103 -0.998 . . . . 0.0 108.775 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -105.23 99.79 9.4 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.546 -0.721 . . . . 0.0 109.102 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.1 t -74.56 145.85 43.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.608 -0.683 . . . . 0.0 109.343 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -139.91 155.69 47.05 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.1 pt -133.33 151.05 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 CA-C-O 121.252 0.549 . . . . 0.0 109.592 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -151.94 141.48 21.69 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 19.8 mt -74.38 139.01 43.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.283 -0.885 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.474 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 22.4 mmt180 . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.234 -0.916 . . . . 0.0 109.465 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.41 143.22 97.95 Favored 'Trans proline' 0 N--CA 1.502 2.022 0 C-N-CA 121.965 1.776 . . . . 0.0 111.921 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.523 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.0 mp -63.35 -43.94 96.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.144 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -63.76 -47.63 80.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.812 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -63.77 -35.76 81.65 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.363 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 ttt -64.15 -61.0 2.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.396 -0.815 . . . . 0.0 110.032 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -65.21 -39.95 93.47 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.15 -0.969 . . . . 0.0 109.974 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -61.12 -45.3 95.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.001 -1.062 . . . . 0.0 109.882 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -61.56 -43.56 98.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.023 -1.048 . . . . 0.0 109.981 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.55 -48.15 35.24 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 110.706 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.443 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.0 mt -63.11 -44.63 99.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 0.0 109.542 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -66.5 -35.16 79.57 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.304 -0.872 . . . . 0.0 109.936 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -38.65 91.97 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.0 110.02 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 m -110.41 11.54 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 121.608 -0.683 . . . . 0.0 109.789 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -59.82 -23.49 63.39 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.879 -1.138 . . . . 0.0 108.713 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 51.77 29.04 5.41 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.6 -0.688 . . . . 0.0 109.85 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 55.4 8.42 0.29 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.374 -0.829 . . . . 0.0 110.5 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.6 p -87.7 -3.52 58.96 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.812 -1.18 . . . . 0.0 108.804 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.66 -59.03 5.0 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.461 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 99.1 m95 -75.4 177.22 6.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.407 -1.055 . . . . 0.0 109.442 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 137.3 9.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.264 -0.898 . . . . 0.0 108.874 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -69.39 125.71 27.54 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.286 -0.884 . . . . 0.0 109.424 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.4 tp -57.73 -40.0 78.59 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.675 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -57.42 -42.27 82.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.064 -1.022 . . . . 0.0 109.132 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.17 89.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.221 -0.924 . . . . 0.0 109.528 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.63 -48.39 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 109.493 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.04 -42.7 99.88 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.1 p -66.25 -40.79 90.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -1.19 . . . . 0.0 109.967 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -61.61 -44.69 96.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.1 mt -61.41 -41.83 97.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.123 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.49 -39.55 84.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.346 -0.846 . . . . 0.0 109.094 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -61.6 -46.09 91.34 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.277 -0.889 . . . . 0.0 109.481 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -88.57 -4.51 58.57 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.145 -0.972 . . . . 0.0 109.167 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 36' ' ' LEU . 4.4 m-20 -153.56 64.28 4.87 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.0 -18.5 63.93 Favored 'Trans proline' 0 N--CA 1.494 1.506 0 C-N-CA 121.5 1.467 . . . . 0.0 111.034 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.0 m -76.14 -7.01 53.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 108.578 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -75.95 164.62 25.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.533 -0.73 . . . . 0.0 109.3 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -131.13 79.61 70.55 Favored Pre-proline 0 N--CA 1.504 2.261 0 O-C-N 121.611 -0.681 . . . . 0.0 110.116 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.17 -36.33 92.94 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.95 1.767 . . . . 0.0 111.142 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.58 -34.32 77.55 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.298 0.57 . . . . 0.0 110.158 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 49' ' ' GLY . 44.6 t30 -60.0 -36.59 77.54 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 108.99 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -78.36 24.56 0.26 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.243 -0.911 . . . . 0.0 109.265 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 74.51 161.8 8.48 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.513 ' C ' ' H ' ' A' ' 52' ' ' ARG . 99.5 m-70 -90.7 123.84 34.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.273 -1.134 . . . . 0.0 109.558 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 69.59 -21.63 0.43 Allowed Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 50' ' ' HIS . 76.2 mtp85 -71.39 -1.88 14.57 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.185 -1.185 . . . . 0.0 109.007 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.9 tp -61.77 -37.71 85.33 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -58.89 -41.97 88.44 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.361 -0.837 . . . . 0.0 109.319 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -65.65 -31.65 72.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.191 -0.943 . . . . 0.0 109.862 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.7 tpt -64.78 -48.6 73.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.87 -1.144 . . . . 0.0 109.962 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.0 m -75.14 -16.27 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.116 -0.99 . . . . 0.0 109.678 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -60.92 -28.13 68.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.424 -0.797 . . . . 0.0 109.688 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -70.37 -3.3 16.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.133 -0.979 . . . . 0.0 109.006 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.0 mt -99.92 124.59 45.41 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.499 -0.75 . . . . 0.0 109.058 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.7 p-10 -73.44 -36.63 65.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.441 -0.787 . . . . 0.0 111.622 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.461 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 51.6 p90 -73.5 18.81 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.684 -1.26 . . . . 0.0 110.907 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.6 mt -136.33 125.03 23.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.318 -0.864 . . . . 0.0 109.165 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.8 m -89.31 141.95 28.09 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.367 -0.833 . . . . 0.0 109.09 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.5 t -116.06 130.35 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.618 0.723 . . . . 0.0 109.396 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.461 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 51.1 tt0 -153.78 150.63 28.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -140.48 127.91 21.32 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.384 -0.823 . . . . 0.0 109.079 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.7 p -81.71 154.45 26.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.889 -1.132 . . . . 0.0 108.724 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.606 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -90.34 132.45 35.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.215 -0.928 . . . . 0.0 108.711 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -150.66 98.82 2.67 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.886 -1.134 . . . . 0.0 109.643 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 55.51 -140.89 39.54 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 62.1 m -86.32 -7.84 58.17 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.26 -1.141 . . . . 0.0 109.655 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -103.14 118.21 36.28 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.339 -0.851 . . . . 0.0 109.491 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.11 134.82 33.47 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -100.87 104.31 15.53 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 m -74.2 148.84 41.26 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.435 -0.791 . . . . 0.0 109.174 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -141.5 152.04 43.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.426 -0.796 . . . . 0.0 108.945 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.3 pt -139.97 152.12 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.659 -0.65 . . . . 0.0 109.437 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -157.04 154.76 30.05 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.93 138.18 58.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.116 -0.99 . . . . 0.0 109.757 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.8 ttp85 . . . . . 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 109.799 -179.487 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.574 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 44.6 Cg_exo -58.41 127.9 26.44 Favored 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 121.095 1.197 . . . . 0.0 112.055 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.53 -40.27 80.81 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.464 -0.773 . . . . 0.0 109.091 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -56.82 -45.63 82.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -0.94 . . . . 0.0 109.307 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -65.0 -36.97 86.13 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.355 -0.841 . . . . 0.0 109.217 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.4 ttp -62.66 -53.74 49.93 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.418 -0.801 . . . . 0.0 110.0 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -70.7 -41.5 71.89 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.917 -1.115 . . . . 0.0 110.123 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.2 m -60.58 -45.89 92.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.883 -1.135 . . . . 0.0 110.119 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -61.41 -45.15 95.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.47 77.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.204 -0.935 . . . . 0.0 111.106 -178.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.1 mt -61.87 -46.96 95.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.114 -0.991 . . . . 0.0 109.451 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.88 -29.23 69.07 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.433 -0.792 . . . . 0.0 109.8 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.22 -42.89 96.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.149 -0.97 . . . . 0.0 110.708 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ARG . 12.6 m -111.98 20.45 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.512 -0.742 . . . . 0.0 109.989 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 2.82 1.31 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.825 -1.172 . . . . 0.0 109.321 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.0 mmt180 61.19 -146.34 0.44 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -59.9 -49.99 75.54 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.626 -0.671 . . . . 0.0 110.178 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t 176.76 87.72 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.284 -0.885 . . . . 0.0 108.804 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.59 -171.2 38.59 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.468 -1.348 . . . . 0.0 109.888 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -58.77 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.67 -0.9 . . . . 0.0 109.556 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.69 142.36 30.01 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.462 -0.774 . . . . 0.0 109.166 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.93 132.85 48.09 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.161 -0.962 . . . . 0.0 110.085 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.27 -39.79 80.14 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.206 -0.934 . . . . 0.0 109.275 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.5 p -55.8 -42.4 75.54 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 109.241 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.39 87.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.582 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.29 -48.29 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.096 -1.003 . . . . 0.0 109.901 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.61 -46.74 93.49 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -64.76 -42.89 94.78 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.109 -1.23 . . . . 0.0 110.094 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.536 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 68.3 t80 -61.21 -48.4 81.67 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.232 -0.917 . . . . 0.0 109.736 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 40' ' ' ASP . 90.1 mt -63.12 -41.97 99.44 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.396 -0.815 . . . . 0.0 109.11 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.33 93.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 108.936 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -64.14 -44.77 91.15 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.295 -0.878 . . . . 0.0 109.707 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.536 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.8 m-80 -82.99 -8.24 59.58 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.188 -0.945 . . . . 0.0 109.494 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.48 ' N ' ' O ' ' A' ' 36' ' ' LEU . 5.1 m-20 -153.76 77.22 5.83 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.37 -30.29 62.46 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.804 1.669 . . . . 0.0 111.115 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 83.6 p -69.01 -12.47 61.72 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.617 -0.677 . . . . 0.0 109.678 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -76.84 122.85 25.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.975 . . . . 0.0 108.399 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -115.41 96.77 46.82 Favored Pre-proline 0 N--CA 1.506 2.368 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.7 -7.42 20.12 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 CA-C-N 120.187 1.103 . . . . 0.0 111.254 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -62.79 -41.45 99.28 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -62.76 -37.48 86.77 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.439 -0.788 . . . . 0.0 109.151 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -81.51 26.4 0.47 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.274 -0.891 . . . . 0.0 109.359 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 56.75 98.91 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -48.93 -28.66 3.99 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -1.187 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.47 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -96.18 -55.54 1.27 Allowed Glycine 0 N--CA 1.502 3.072 0 N-CA-C 108.771 -1.731 . . . . 0.0 108.771 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -62.94 2.75 0.28 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.39 -1.065 . . . . 0.0 109.607 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 51' ' ' GLY . 57.4 tp -60.44 -42.23 95.69 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.2 t -62.91 -25.93 68.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.489 -0.757 . . . . 0.0 109.739 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -85.09 -34.97 22.1 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 120.976 -1.077 . . . . 0.0 110.056 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.69 -43.58 88.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.887 -1.133 . . . . 0.0 109.872 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 m -63.33 -20.65 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.082 -1.011 . . . . 0.0 109.647 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -69.45 -19.78 63.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.357 -0.839 . . . . 0.0 109.537 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -86.6 0.4 54.51 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.204 -0.935 . . . . 0.0 109.616 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' PHE . 90.5 mt -85.44 -5.48 59.29 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.922 -1.111 . . . . 0.0 109.015 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 63' ' ' LEU . 8.6 m-20 57.85 -65.29 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.526 -0.734 . . . . 0.0 111.958 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 60' ' ' LEU . 52.6 p90 -63.21 19.07 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.63 -1.294 . . . . 0.0 111.999 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 61' ' ' ASP . 8.1 mt -136.21 128.91 30.8 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.061 -1.024 . . . . 0.0 108.875 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 60.8 m -89.26 140.74 29.18 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.8 t -119.18 131.52 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 O-C-N 121.482 -0.761 . . . . 0.0 109.239 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -141.56 151.85 43.56 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.92 120.03 41.13 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -91.57 151.03 20.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.243 -0.911 . . . . 0.0 108.57 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 69' ' ' ARG . 15.0 mtm180 -91.85 114.27 26.76 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -149.99 118.01 6.32 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.267 -0.896 . . . . 0.0 110.161 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.68 -171.11 2.55 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.2 m -78.41 28.94 0.19 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.412 -1.052 . . . . 0.0 109.61 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -144.78 119.56 9.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.301 -0.874 . . . . 0.0 109.076 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 mt -68.12 132.68 47.64 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 m170 -101.31 119.13 38.29 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.557 -0.714 . . . . 0.0 109.229 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.3 t -71.41 149.74 45.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 109.397 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -141.2 148.76 40.47 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -133.64 147.32 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.558 -0.714 . . . . 0.0 109.563 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -157.98 154.02 27.08 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.29 136.85 57.08 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.607 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.6 m80 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -47.84 135.04 23.02 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.353 1.369 . . . . 0.0 111.969 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.9 -42.69 97.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.171 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -59.97 -47.82 84.22 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.251 -0.906 . . . . 0.0 109.437 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.3 -35.44 80.38 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.724 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.58 -50.83 69.73 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.279 -0.888 . . . . 0.0 110.35 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -69.16 -48.68 61.61 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.859 -1.151 . . . . 0.0 110.312 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.4 p -60.65 -43.84 97.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.975 -1.078 . . . . 0.0 110.257 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m -60.64 -44.32 96.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.11 -0.994 . . . . 0.0 110.176 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.54 -41.96 75.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 110.505 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 21' ' ' ALA . 93.6 mt -63.64 -46.18 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.161 -0.962 . . . . 0.0 109.93 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.66 -33.96 77.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.025 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.64 91.71 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.166 -0.959 . . . . 0.0 109.913 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.1 m -101.74 -2.78 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 O-C-N 121.364 -0.835 . . . . 0.0 109.968 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.506 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -62.12 -23.45 66.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.966 -1.084 . . . . 0.0 108.896 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 61.74 -2.97 0.24 Allowed 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.402 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.506 ' H ' ' C ' ' A' ' 21' ' ' ALA . 8.8 p30 -175.11 -101.41 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.799 -1.188 . . . . 0.0 108.827 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.48 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 29.9 t -162.02 91.96 0.82 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.925 -1.109 . . . . 0.0 108.89 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.09 -149.35 8.23 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.418 ' CH2' ' CD ' ' A' ' 66' ' ' GLN . 99.2 m95 -68.04 -178.44 1.01 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.632 -0.922 . . . . 0.0 110.044 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -159.57 149.92 19.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.372 -0.83 . . . . 0.0 108.912 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 40.6 mp0 -76.98 128.42 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.244 -0.91 . . . . 0.0 109.581 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.85 -39.85 78.69 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -55.63 -43.0 75.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.067 -1.021 . . . . 0.0 109.612 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.22 90.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.131 -0.98 . . . . 0.0 109.546 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.3 t -62.7 -48.22 89.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.163 -0.961 . . . . 0.0 109.544 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.85 -48.65 85.19 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -63.2 -42.63 99.35 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.179 -1.189 . . . . 0.0 109.505 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.557 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 83.7 t80 -60.12 -45.51 92.75 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.851 . . . . 0.0 109.505 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 40' ' ' ASP . 66.5 mt -61.67 -43.06 99.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.963 . . . . 0.0 109.187 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.46 91.0 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.16 -0.962 . . . . 0.0 109.132 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.9 -44.69 95.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.885 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.557 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.2 m-80 -89.61 2.04 55.21 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.247 -0.908 . . . . 0.0 109.226 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 36' ' ' LEU . 50.0 t0 -162.81 73.8 2.06 Favored Pre-proline 0 N--CA 1.493 1.696 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.03 -14.96 45.51 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.405 1.403 . . . . 0.0 111.306 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 88.2 p -74.95 -8.96 58.01 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -72.94 141.09 47.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.428 -0.795 . . . . 0.0 109.385 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -119.72 92.56 46.53 Favored Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.67 -0.644 . . . . 0.0 109.919 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.09 -19.29 40.38 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.009 1.806 . . . . 0.0 111.525 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -63.72 -36.53 84.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.505 -0.747 . . . . 0.0 109.199 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.02 -36.24 82.91 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.114 -0.991 . . . . 0.0 108.471 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -78.57 7.21 7.11 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.829 . . . . 0.0 109.394 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.92 152.23 0.04 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.449 ' C ' ' H ' ' A' ' 52' ' ' ARG . 59.3 t-80 -78.41 132.15 37.22 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -1.029 . . . . 0.0 109.603 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.57 -32.61 0.85 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.449 ' H ' ' C ' ' A' ' 50' ' ' HIS . 64.5 ttt180 -67.12 -12.01 58.8 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.272 -1.134 . . . . 0.0 108.49 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -61.34 -42.96 99.54 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 108.587 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -62.47 -42.82 99.75 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -69.14 -32.23 71.44 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.953 . . . . 0.0 109.918 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -46.31 88.99 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.095 -1.003 . . . . 0.0 109.783 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.1 -24.74 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.171 -0.955 . . . . 0.0 109.246 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.95 -29.27 69.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.504 -0.747 . . . . 0.0 109.725 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -70.87 -3.04 17.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.951 . . . . 0.0 109.783 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 64.2 mt -102.38 125.01 48.96 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 35.4 p-10 -68.19 -38.7 82.3 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.341 -0.85 . . . . 0.0 111.536 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.419 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 45.2 p90 -76.45 16.0 0.54 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.715 -1.24 . . . . 0.0 110.433 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.408 HD13 ' N ' ' A' ' 64' ' ' THR . 0.7 OUTLIER -133.53 117.04 16.66 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.324 -0.86 . . . . 0.0 109.053 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.408 ' N ' HD13 ' A' ' 63' ' ' LEU . 62.7 m -90.4 141.81 28.36 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.213 -0.929 . . . . 0.0 109.711 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.5 t -126.7 133.79 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CD ' ' CH2' ' A' ' 26' ' ' TRP . 86.6 mt-30 -141.05 137.04 32.62 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -102.37 121.18 41.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.52 -0.737 . . . . 0.0 109.122 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.8 m -92.45 141.74 28.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.279 -0.888 . . . . 0.0 108.998 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.593 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -88.11 90.42 8.38 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.269 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -99.61 106.3 18.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.023 . . . . 0.0 109.676 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.33 -138.76 47.48 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.94 -8.4 57.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.273 -1.133 . . . . 0.0 109.802 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -113.0 122.77 48.61 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.441 -0.787 . . . . 0.0 109.805 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mp -85.01 131.51 34.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -107.7 125.61 51.59 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-O 121.521 0.677 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 t -70.8 154.64 41.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.547 -0.72 . . . . 0.0 109.635 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -137.84 154.86 49.46 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.9 pt -136.99 151.42 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 CA-C-O 121.444 0.64 . . . . 0.0 109.673 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.1 ttp85 -151.19 144.9 25.04 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.4 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -90.49 113.41 25.37 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.301 -0.874 . . . . 0.0 109.236 -178.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.4 ' N ' HD13 ' A' ' 80' ' ' LEU . 61.6 ttm-85 . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.938 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 . . . . . 0 N--CA 1.499 1.997 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -45.03 138.02 9.26 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 121.573 1.516 . . . . 0.0 112.386 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 mt -63.58 -40.94 98.25 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.491 -0.755 . . . . 0.0 109.167 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.54 -38.39 77.69 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.472 -0.768 . . . . 0.0 108.947 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -61.73 -42.08 98.49 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.315 -0.865 . . . . 0.0 109.351 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.413 ' SD ' HD22 ' A' ' 36' ' ' LEU . 47.9 mmm -63.54 -44.85 93.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.137 -0.977 . . . . 0.0 109.326 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -69.5 -44.31 71.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.182 -0.949 . . . . 0.0 110.094 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.7 m -62.75 -46.23 89.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.058 -1.026 . . . . 0.0 110.206 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -67.71 -39.1 84.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.283 -0.886 . . . . 0.0 110.202 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -75.47 -48.89 20.64 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.048 -1.032 . . . . 0.0 110.897 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.15 -45.0 99.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.047 -1.033 . . . . 0.0 109.347 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.86 -31.76 72.58 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.383 -0.823 . . . . 0.0 109.71 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.52 96.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.986 -1.071 . . . . 0.0 110.303 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.1 m -118.97 23.94 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.477 -0.764 . . . . 0.0 109.613 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.04 -33.49 70.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.905 -1.122 . . . . 0.0 109.372 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 24' ' ' SER . 20.5 mtm180 51.8 97.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.819 . . . . 0.0 110.476 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 51.07 -82.7 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 110.668 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' ARG . 11.6 p -65.14 157.86 27.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.184 -0.948 . . . . 0.0 109.642 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.1 1.85 78.34 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.411 ' CH2' ' OE1' ' A' ' 66' ' ' GLN . 96.5 m95 -85.03 148.8 25.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.074 -1.25 . . . . 0.0 109.26 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.41 145.68 31.23 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.359 -0.838 . . . . 0.0 109.027 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.14 132.35 46.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.897 . . . . 0.0 109.497 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 53' ' ' LEU . 31.2 tp -56.73 -39.94 74.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.46 -0.775 . . . . 0.0 109.275 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.6 m -58.57 -44.04 89.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.141 -0.974 . . . . 0.0 109.267 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.38 -36.48 80.37 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 109.593 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.42 -48.24 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.232 -0.917 . . . . 0.0 109.312 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.82 -48.78 78.3 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.2 t -62.17 -45.11 94.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.125 -1.22 . . . . 0.0 109.745 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.466 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 74.7 t80 -60.09 -48.53 81.34 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.295 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.413 HD22 ' SD ' ' A' ' 12' ' ' MET . 98.2 mt -65.93 -39.56 90.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 109.382 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.53 75.98 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.057 -1.027 . . . . 0.0 109.824 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -62.44 -41.08 98.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.075 -1.016 . . . . 0.0 109.526 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.466 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 5.0 m120 -64.36 -40.28 95.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.221 -0.924 . . . . 0.0 109.353 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.28 152.58 58.36 Favored Pre-proline 0 N--CA 1.497 1.922 0 O-C-N 121.19 -0.944 . . . . 0.0 108.683 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -45.97 -43.91 19.4 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.439 1.426 . . . . 0.0 111.312 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.9 m -145.65 -92.82 0.09 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.6 t80 61.81 144.71 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.912 0.863 . . . . 0.0 108.99 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -158.76 94.35 1.87 Allowed Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 121.536 -0.727 . . . . 0.0 109.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -70.35 -22.77 28.9 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 CA-C-N 119.536 0.87 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -66.05 -51.68 56.0 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.321 -0.862 . . . . 0.0 109.423 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -64.0 -11.23 27.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.238 -0.914 . . . . 0.0 110.341 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.451 ' HE3' ' HE ' ' A' ' 52' ' ' ARG . 2.4 m95 -81.16 3.01 25.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.904 -1.123 . . . . 0.0 108.954 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.47 164.2 12.6 Favored Glycine 0 N--CA 1.51 3.623 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -73.24 129.36 37.88 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.314 -1.109 . . . . 0.0 109.83 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . 83.82 -89.87 1.57 Allowed Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.451 ' HE ' ' HE3' ' A' ' 48' ' ' TRP . 1.2 tmt_? 50.14 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.994 -0.709 . . . . 0.0 110.613 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.561 ' N ' ' O ' ' A' ' 51' ' ' GLY . 41.6 tp -49.37 -35.99 20.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.0 t -66.58 -36.53 82.86 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.295 0.569 . . . . 0.0 109.649 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -86.2 -32.44 21.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.995 -1.066 . . . . 0.0 110.244 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.8 mtp -64.38 -38.95 92.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.009 -1.057 . . . . 0.0 108.825 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.2 -26.78 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 120.757 -1.214 . . . . 0.0 110.069 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.35 -40.43 82.17 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.187 -0.946 . . . . 0.0 110.635 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -75.43 -0.47 20.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.923 -1.11 . . . . 0.0 110.263 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.1 mt -102.65 115.42 30.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.234 -0.917 . . . . 0.0 109.267 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.409 ' C ' ' H ' ' A' ' 63' ' ' LEU . 68.0 t0 -65.87 -42.5 90.3 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.355 -0.841 . . . . 0.0 111.473 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -71.87 15.32 0.15 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.868 -1.145 . . . . 0.0 110.806 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.412 HD13 ' N ' ' A' ' 64' ' ' THR . 0.6 OUTLIER -129.23 117.87 21.43 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.391 -0.818 . . . . 0.0 108.954 -179.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.412 ' N ' HD13 ' A' ' 63' ' ' LEU . 51.0 m -88.2 144.74 26.27 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.302 -0.874 . . . . 0.0 109.29 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 49.1 t -118.69 130.79 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 CA-C-O 121.531 0.681 . . . . 0.0 109.851 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.411 ' OE1' ' CH2' ' A' ' 26' ' ' TRP . 49.8 tt0 -145.13 152.64 40.37 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.492 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 54.7 mp0 -127.73 118.11 23.18 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 p -79.43 153.73 29.47 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.158 -0.964 . . . . 0.0 108.433 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 69' ' ' ARG . 22.4 mtt180 -96.24 134.6 39.15 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -150.05 101.82 3.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.291 -0.881 . . . . 0.0 109.623 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.12 -140.73 44.49 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.9 p -86.44 -7.88 58.07 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.283 -1.128 . . . . 0.0 109.828 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -118.67 110.45 17.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.596 -0.69 . . . . 0.0 109.627 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.51 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -81.03 149.09 29.41 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -107.46 129.56 54.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.513 -0.742 . . . . 0.0 109.364 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.6 p -70.62 151.57 44.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.451 -0.781 . . . . 0.0 109.395 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -144.36 156.27 44.16 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.0 pt -138.29 155.02 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.479 -0.763 . . . . 0.0 109.852 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -154.21 146.99 24.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.386 -0.821 . . . . 0.0 108.804 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 69.0 mt -69.05 136.3 52.16 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.218 -0.926 . . . . 0.0 108.634 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 . . . . . 0 N--CA 1.496 1.832 0 O-C-N 121.274 -0.891 . . . . 0.0 109.639 -179.315 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.35 134.94 15.83 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.608 1.539 . . . . 0.0 112.099 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.38 -41.32 96.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.379 -0.826 . . . . 0.0 109.455 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.33 -41.76 72.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.209 -0.932 . . . . 0.0 109.53 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -65.26 -44.51 87.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.15 -0.969 . . . . 0.0 108.635 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 81.3 mtp -62.55 -49.05 76.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.862 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -68.64 -42.89 77.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.001 -1.062 . . . . 0.0 109.829 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -63.2 -48.05 79.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.942 -1.099 . . . . 0.0 109.993 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.0 p -65.93 -40.32 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.09 -1.006 . . . . 0.0 110.223 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.47 -48.66 31.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.094 -1.004 . . . . 0.0 110.74 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.6 mt -62.88 -45.03 99.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 109.495 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -66.37 -32.83 74.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.58 91.61 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.138 -0.977 . . . . 0.0 110.361 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.3 m -117.96 20.15 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.506 -0.746 . . . . 0.0 109.812 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.14 -27.32 66.97 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.056 -1.027 . . . . 0.0 109.662 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 51.21 85.81 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.724 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 25' ' ' GLY . 31.8 t70 52.78 38.8 27.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.07 -1.019 . . . . 0.0 110.499 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 26' ' ' TRP . 4.1 p 62.01 1.24 0.64 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.86 . . . . 0.0 109.688 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 23' ' ' ASP . . . -68.46 76.08 0.27 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.68 ' H ' ' NH2' ' A' ' 79' ' ' ARG . 88.7 m95 40.7 -165.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.896 -0.767 . . . . 0.0 111.216 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.74 133.03 10.85 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -71.38 125.98 28.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 109.577 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.6 tp -54.66 -40.29 68.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 109.265 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -58.53 -43.6 89.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.173 -0.955 . . . . 0.0 109.092 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.28 93.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 109.541 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.95 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.04 -1.037 . . . . 0.0 109.064 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.98 85.71 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.2 t -61.78 -43.37 98.98 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.159 -1.201 . . . . 0.0 109.729 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 72.2 t80 -59.52 -46.7 88.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.278 -0.889 . . . . 0.0 109.549 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.1 mt -63.24 -40.4 97.33 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.287 -0.883 . . . . 0.0 109.209 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.09 -47.86 65.02 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.94 -1.1 . . . . 0.0 109.58 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -63.89 -41.41 97.71 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 109.298 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.417 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 10.5 m120 -89.02 8.39 29.92 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.047 -1.033 . . . . 0.0 109.253 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.476 ' N ' ' O ' ' A' ' 36' ' ' LEU . 45.0 t0 -153.38 78.44 5.74 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.335 -0.853 . . . . 0.0 109.173 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.415 ' O ' ' CB ' ' A' ' 42' ' ' SER . 21.1 Cg_exo -62.96 156.52 53.89 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.35 2.033 . . . . 0.0 111.54 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 41' ' ' PRO . 0.9 OUTLIER 75.05 2.68 4.02 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.719 -0.613 . . . . 0.0 109.373 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -93.2 -71.26 0.66 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 55.16 89.42 0.11 Allowed Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.656 -0.652 . . . . 0.0 109.518 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 49' ' ' GLY . 50.8 Cg_exo -54.37 -36.68 88.0 Favored 'Trans proline' 0 N--CA 1.499 1.801 0 C-N-CA 122.246 1.964 . . . . 0.0 111.238 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -58.96 -44.7 91.51 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -47.83 -32.71 6.42 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.345 -0.847 . . . . 0.0 109.921 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 25.5 p-90 -134.37 31.89 3.43 Favored 'General case' 0 N--CA 1.504 2.225 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -61.9 -76.86 0.22 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.468 ' ND1' ' O ' ' A' ' 50' ' ' HIS . 62.7 t-80 55.19 3.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.686 -0.89 . . . . 0.0 110.447 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 49' ' ' GLY . . . 74.35 -18.29 2.2 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.535 HH11 ' HG3' ' A' ' 52' ' ' ARG . 8.9 ptm180 -61.08 -3.92 0.95 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.126 -1.22 . . . . 0.0 109.195 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 51' ' ' GLY . 58.8 tp -62.67 -44.25 96.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.315 -0.866 . . . . 0.0 108.806 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.6 p -65.13 -34.83 79.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.334 -0.854 . . . . 0.0 109.353 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -74.87 -33.53 62.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.024 . . . . 0.0 109.507 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.77 -46.79 86.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.873 -1.142 . . . . 0.0 109.585 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.0 -23.9 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.376 -0.827 . . . . 0.0 109.826 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.16 -32.1 71.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.28 -0.888 . . . . 0.0 109.433 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -70.88 -1.91 13.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.141 -0.974 . . . . 0.0 109.616 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -103.65 122.8 45.77 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.427 -0.795 . . . . 0.0 108.908 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.458 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.2 p-10 -73.89 -37.5 64.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.414 -0.804 . . . . 0.0 111.582 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.458 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 50.2 p90 -72.19 19.29 0.07 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.653 -1.28 . . . . 0.0 110.976 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.435 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.0 mt -137.62 125.86 23.14 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.442 -0.786 . . . . 0.0 108.974 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.4 m -92.5 133.56 35.81 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.01 130.87 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.33 0 CA-C-O 121.545 0.688 . . . . 0.0 109.513 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -149.7 144.4 26.07 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.21 122.68 47.01 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.457 -0.777 . . . . 0.0 109.139 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.9 m -78.77 149.54 32.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 109.403 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.57 126.24 33.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.609 -0.682 . . . . 0.0 109.294 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.55 ' ND2' ' NE2' ' A' ' 75' ' ' HIS . 51.4 t30 -149.91 89.62 1.62 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.335 -0.853 . . . . 0.0 109.883 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.36 -140.67 46.67 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.0 p -86.5 -7.55 58.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.197 -1.178 . . . . 0.0 109.992 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -102.98 122.8 45.36 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.3 mt -87.15 129.4 34.95 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.55 ' NE2' ' ND2' ' A' ' 70' ' ' ASN . 17.4 m-70 -98.12 116.79 31.07 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.388 -0.82 . . . . 0.0 109.228 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.7 m -71.96 144.37 48.92 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.499 -0.751 . . . . 0.0 109.186 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -143.39 150.99 39.88 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.22 149.58 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.609 -0.682 . . . . 0.0 109.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.68 ' NH2' ' H ' ' A' ' 26' ' ' TRP . 6.9 ptp180 -155.42 156.49 35.43 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.5 137.22 46.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.893 . . . . 0.0 109.26 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 . . . . . 0 C--N 1.301 -1.517 0 O-C-N 121.527 -0.733 . . . . 0.0 109.935 -179.974 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 . . . . . 0 N--CA 1.495 1.776 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -49.52 134.68 32.95 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 121.412 1.408 . . . . 0.0 112.148 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.472 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.8 mp -64.56 -41.35 96.36 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 108.989 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -56.39 -48.27 77.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 109.81 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.11 -39.2 92.77 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.193 -0.942 . . . . 0.0 109.477 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.5 ttt -62.78 -53.02 60.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -69.94 -41.82 74.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.914 -1.116 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.6 -47.57 83.2 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.078 -1.014 . . . . 0.0 109.855 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.8 m -62.26 -44.27 96.92 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.291 -0.881 . . . . 0.0 110.208 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.52 -48.12 50.8 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.055 -1.028 . . . . 0.0 110.548 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -62.78 -44.1 99.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.026 -1.046 . . . . 0.0 109.461 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.25 -35.33 80.13 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.176 -0.953 . . . . 0.0 110.01 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.43 -57.9 8.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.067 -1.021 . . . . 0.0 110.621 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.4 m -97.06 27.26 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 121.323 -0.861 . . . . 0.0 110.063 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -55.39 -32.78 62.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.961 -1.087 . . . . 0.0 110.08 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.671 HH11 ' HG3' ' A' ' 22' ' ' ARG . 9.4 mtt85 48.65 -94.93 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.973 -1.079 . . . . 0.0 110.096 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' N ' ' O ' ' A' ' 21' ' ' ALA . 67.8 t0 -62.69 -53.27 56.94 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.273 -0.892 . . . . 0.0 111.189 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.45 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 80.9 p -171.39 -160.24 0.17 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.199 -0.938 . . . . 0.0 109.567 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -50.21 -17.78 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -82.43 136.59 34.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.161 -1.2 . . . . 0.0 108.974 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.88 145.34 31.54 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.47 -0.769 . . . . 0.0 109.328 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.02 131.53 48.92 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.27 -0.894 . . . . 0.0 109.551 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 tp -57.2 -39.88 76.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.244 -0.91 . . . . 0.0 109.554 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -57.74 -41.4 81.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.112 -0.993 . . . . 0.0 109.201 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.373 -0.83 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.18 -48.46 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 109.477 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.66 -48.02 84.66 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.91 -43.85 97.69 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.291 -1.123 . . . . 0.0 109.638 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.539 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 87.6 t80 -60.35 -46.36 90.2 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.186 -0.946 . . . . 0.0 109.263 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.53 -38.92 92.99 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.42 -0.8 . . . . 0.0 109.173 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.34 -46.84 76.38 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.536 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -64.47 -44.17 91.87 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.897 . . . . 0.0 109.517 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.539 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.4 m-80 -65.4 -40.14 93.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.864 . . . . 0.0 110.362 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -90.76 167.15 16.97 Favored Pre-proline 0 N--CA 1.505 2.293 0 O-C-N 121.317 -0.865 . . . . 0.0 108.979 -179.265 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.08 -45.06 43.8 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.497 1.465 . . . . 0.0 111.252 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 t -179.03 88.67 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.426 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 36.4 t80 -61.38 174.4 0.73 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.336 -0.852 . . . . 0.0 109.05 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -133.4 76.18 68.43 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.485 -0.759 . . . . 0.0 110.15 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.56 -37.96 94.6 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.194 1.929 . . . . 0.0 111.932 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -60.65 -37.24 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.606 -0.684 . . . . 0.0 109.233 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -59.61 -40.02 86.15 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -82.55 31.47 0.41 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.378 -0.826 . . . . 0.0 108.993 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.92 169.75 4.98 Favored Glycine 0 N--CA 1.495 2.586 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -68.16 -39.42 82.62 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.462 -1.022 . . . . 0.0 109.652 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.6 8.51 2.57 Favored Glycine 0 N--CA 1.504 3.194 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -68.1 -12.27 60.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.169 -1.195 . . . . 0.0 108.639 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.79 -40.38 94.99 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.1 p -60.79 -36.95 80.28 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.349 -0.844 . . . . 0.0 109.032 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -69.37 -36.81 77.22 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.377 -0.827 . . . . 0.0 110.12 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.1 tpt -61.22 -47.81 84.41 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.897 -1.127 . . . . 0.0 109.871 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.45 -25.46 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.119 -0.988 . . . . 0.0 109.394 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -62.4 -32.55 73.39 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.374 -0.829 . . . . 0.0 109.513 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -64.04 -33.44 75.76 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.411 -0.806 . . . . 0.0 108.874 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.02 142.53 47.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.391 -0.818 . . . . 0.0 109.433 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.7 p-10 -90.62 -34.62 15.39 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.282 -0.886 . . . . 0.0 111.273 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.411 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 40.4 p90 -73.04 16.27 0.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.678 -1.264 . . . . 0.0 110.396 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.1 mt -134.06 127.2 31.73 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.1 m -95.16 134.8 37.49 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -118.04 131.27 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 121.608 -0.682 . . . . 0.0 109.468 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -140.24 137.42 34.25 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.461 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 40.3 mp0 -94.57 134.78 36.76 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -0.793 . . . . 0.0 109.291 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.7 m -117.37 129.92 56.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.644 -0.66 . . . . 0.0 109.346 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -75.11 138.44 42.08 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.775 -1.203 . . . . 0.0 109.735 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -151.0 92.05 1.77 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.72 -140.71 48.05 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.8 p -84.43 -6.21 59.36 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.44 -1.035 . . . . 0.0 110.356 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -123.2 97.72 5.55 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.508 -0.745 . . . . 0.0 109.852 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.9 134.52 50.96 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -103.41 128.35 50.56 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.53 -0.731 . . . . 0.0 109.677 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.5 t -71.29 154.35 41.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.633 -0.667 . . . . 0.0 109.601 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -136.56 145.65 45.23 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.3 pt -132.35 157.1 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -143.51 147.54 34.64 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.483 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -82.79 119.24 24.1 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.483 ' N ' HD13 ' A' ' 80' ' ' LEU . 79.4 ttt-85 . . . . . 0 N--CA 1.486 1.372 0 O-C-N 121.24 -0.912 . . . . 0.0 109.765 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.55 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.815 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 34.7 Cg_exo -61.52 138.79 78.07 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.217 1.945 . . . . 0.0 111.738 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.485 ' N ' HD22 ' A' ' 9' ' ' LEU . 3.6 mm? -64.96 -41.96 95.02 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.184 -0.948 . . . . 0.0 108.991 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -65.22 -45.64 83.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 109.86 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -64.64 -35.84 82.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.66 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.5 ttt -61.71 -61.43 2.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.29 -0.881 . . . . 0.0 109.852 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -66.86 -40.31 87.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.069 -1.019 . . . . 0.0 110.256 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.9 m -61.75 -46.07 91.21 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.774 -1.204 . . . . 0.0 109.883 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.5 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.039 -1.038 . . . . 0.0 109.966 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.72 -46.75 62.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.479 ' O ' ' N ' ' A' ' 21' ' ' ALA . 98.1 mt -62.56 -45.16 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 109.509 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -67.6 -32.51 73.3 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.093 -1.004 . . . . 0.0 109.093 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.08 -25.71 67.92 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.29 -0.882 . . . . 0.0 109.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.1 m -131.89 19.43 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.423 -0.798 . . . . 0.0 110.335 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.86 -24.75 66.16 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.887 -1.133 . . . . 0.0 108.893 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 51.81 178.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.472 -0.768 . . . . 0.0 110.267 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -68.73 -18.67 64.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.617 -0.677 . . . . 0.0 110.038 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.7 m -74.45 -6.11 46.42 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.901 -1.124 . . . . 0.0 109.469 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -52.51 1.97 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.448 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 96.5 m95 -61.73 178.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -1.13 . . . . 0.0 109.274 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.83 133.13 14.5 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -73.49 132.07 42.49 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.248 -0.907 . . . . 0.0 109.354 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 tp -54.76 -38.45 67.21 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.238 -0.914 . . . . 0.0 109.546 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -57.94 -44.9 87.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.908 -1.12 . . . . 0.0 109.34 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.07 -41.01 99.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.122 -0.986 . . . . 0.0 109.414 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 82.5 t -62.36 -48.14 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.33 -49.17 76.78 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.9 m -61.32 -43.01 99.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.133 -1.216 . . . . 0.0 109.813 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.566 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 69.6 t80 -60.79 -47.35 86.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.253 -0.905 . . . . 0.0 109.385 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 40' ' ' ASP . 80.5 mt -63.0 -40.74 98.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.114 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 41' ' ' PRO . . . -57.51 -48.22 79.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.116 -0.99 . . . . 0.0 109.247 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -61.76 -41.24 97.44 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.204 -0.935 . . . . 0.0 109.132 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.566 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.2 m-80 -80.23 -9.81 59.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.277 -0.889 . . . . 0.0 109.269 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.0 t0 -164.57 71.31 1.55 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.266 -0.896 . . . . 0.0 109.457 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.447 ' N ' ' O ' ' A' ' 37' ' ' ALA . 52.4 Cg_exo -57.14 -30.71 88.07 Favored 'Trans proline' 0 N--CA 1.498 1.788 0 C-N-CA 122.595 2.197 . . . . 0.0 111.489 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -57.11 -13.58 3.08 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.606 -0.684 . . . . 0.0 110.183 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -92.22 -55.51 3.4 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 t0 54.44 85.56 0.19 Allowed Pre-proline 0 N--CA 1.498 1.94 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -54.77 -49.15 17.72 Favored 'Trans proline' 0 N--CA 1.499 1.804 0 C-N-CA 122.328 2.019 . . . . 0.0 112.511 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.498 HH11 ' HG2' ' A' ' 46' ' ' ARG . 66.1 mtp85 -53.19 -52.97 57.11 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.446 -0.784 . . . . 0.0 109.36 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -66.57 -35.09 79.36 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 19.7 t90 -79.34 3.39 18.35 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.193 -0.942 . . . . 0.0 109.777 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.8 126.95 1.01 Allowed Glycine 0 N--CA 1.497 2.714 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -65.91 -45.35 82.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.091 -1.241 . . . . 0.0 109.068 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.8 1.91 0.72 Allowed Glycine 0 N--CA 1.5 2.938 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -66.03 -3.29 5.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.236 . . . . 0.0 109.278 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.2 tp -66.25 -41.6 89.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.122 -0.986 . . . . 0.0 108.668 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 t -59.8 -44.17 94.11 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.438 -0.789 . . . . 0.0 109.66 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -68.09 -30.47 69.65 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.221 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -63.36 -46.97 84.09 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.179 -0.95 . . . . 0.0 109.83 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 57' ' ' VAL . 17.1 m -71.75 -21.09 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.159 -0.963 . . . . 0.0 109.788 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -59.42 -31.99 69.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.147 -0.971 . . . . 0.0 109.557 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -73.47 -3.23 26.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.093 -1.004 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.7 mt -100.22 110.23 22.48 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.368 -0.833 . . . . 0.0 108.862 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.7 t0 -66.12 -37.36 85.53 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 111.523 -179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -71.48 20.03 0.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.727 -1.233 . . . . 0.0 110.981 -178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.2 mt -139.34 127.89 23.05 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.223 -0.923 . . . . 0.0 108.954 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.2 m -90.13 133.2 35.02 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.355 -0.84 . . . . 0.0 109.017 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -120.94 130.73 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.675 -0.641 . . . . 0.0 109.45 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.448 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.6 mt-30 -144.73 153.2 41.44 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.461 -0.774 . . . . 0.0 109.077 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -103.79 144.67 31.17 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.418 -0.801 . . . . 0.0 110.265 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 132.14 44.54 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.638 0.732 . . . . 0.0 109.273 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.668 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -70.21 131.59 44.45 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.542 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 39.7 t-20 -148.69 104.72 3.5 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 120.845 -1.159 . . . . 0.0 109.347 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.28 -140.84 45.45 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 32.1 t -85.22 -3.43 58.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.331 -1.099 . . . . 0.0 110.563 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -134.18 120.39 20.01 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.25 -0.906 . . . . 0.0 109.605 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.75 140.05 58.83 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.678 -0.809 . . . . 0.0 108.828 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.542 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.7 m-70 -102.46 124.32 47.8 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.3 p -71.44 156.63 39.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.491 -0.756 . . . . 0.0 109.035 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.45 149.3 39.07 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.9 pt -142.26 153.92 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.53 -0.731 . . . . 0.0 109.685 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -152.32 152.68 32.41 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.875 . . . . 0.0 108.801 178.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -69.74 135.08 49.33 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.438 ' N ' HD13 ' A' ' 80' ' ' LEU . 41.3 ttp180 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.225 -0.922 . . . . 0.0 109.825 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -55.46 122.66 12.13 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.855 1.703 . . . . 0.0 112.05 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.06 -39.6 93.49 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.647 -0.658 . . . . 0.0 109.527 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -53.84 -48.37 70.01 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.349 -0.845 . . . . 0.0 109.831 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.01 -40.4 94.87 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.221 -0.924 . . . . 0.0 109.341 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.8 ttm -61.85 -51.53 67.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.099 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -70.29 -40.37 74.31 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -61.82 -48.36 80.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.11 -0.994 . . . . 0.0 109.705 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.3 m -62.57 -42.9 99.84 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.155 -0.966 . . . . 0.0 110.262 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.02 -48.29 58.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.035 -1.041 . . . . 0.0 111.034 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.435 ' O ' ' N ' ' A' ' 21' ' ' ALA . 95.3 mt -63.1 -45.35 98.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.093 -1.004 . . . . 0.0 109.789 -178.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.2 -34.24 77.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.706 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.05 -39.1 93.72 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 110.066 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.568 ' C ' ' H ' ' A' ' 22' ' ' ARG . 14.8 m -114.02 16.25 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 121.614 -0.679 . . . . 0.0 110.321 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -63.0 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.68 -1.263 . . . . 0.0 110.041 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.568 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.0 mtp180 -61.13 -142.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.028 -1.045 . . . . 0.0 109.912 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 54.12 -88.5 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.133 -0.979 . . . . 0.0 109.17 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' ARG . 88.5 p -160.58 72.31 0.46 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.74 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.14 -60.88 1.04 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -53.78 178.63 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.324 -1.104 . . . . 0.0 109.821 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -152.8 129.38 10.75 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.13 127.03 29.99 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.141 -0.974 . . . . 0.0 109.47 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.3 tp -57.45 -39.2 75.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.4 -0.812 . . . . 0.0 109.155 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.7 m -57.11 -42.05 80.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.0 109.262 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.51 91.35 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.143 -0.973 . . . . 0.0 109.322 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.9 -47.95 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.17 -0.956 . . . . 0.0 109.224 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.98 -49.79 69.11 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -62.22 -42.33 99.21 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -1.132 . . . . 0.0 109.611 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.3 t80 -60.75 -46.43 90.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.231 -0.918 . . . . 0.0 109.446 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 mt -63.15 -40.01 96.33 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.122 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 109.275 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.04 -43.13 96.46 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 109.595 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 82.9 m-20 -90.51 4.66 50.49 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.242 -0.911 . . . . 0.0 109.136 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 36' ' ' LEU . 21.8 t70 -168.23 77.24 0.85 Allowed Pre-proline 0 N--CA 1.489 1.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.44 -28.14 52.76 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.137 1.891 . . . . 0.0 111.331 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.1 t -63.32 -15.53 57.63 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.462 -0.773 . . . . 0.0 109.587 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -75.01 131.3 40.53 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.227 -0.921 . . . . 0.0 109.085 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 18.6 p30 -138.45 83.07 21.5 Favored Pre-proline 0 N--CA 1.5 2.059 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -58.7 -24.78 72.66 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.464 ' HE ' ' CD2' ' A' ' 50' ' ' HIS . 45.2 mmm-85 -67.42 -42.52 83.06 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.846 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -72.77 -12.13 60.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.291 -0.88 . . . . 0.0 109.153 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -81.7 -2.83 51.89 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.21 -0.931 . . . . 0.0 109.581 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.12 13.81 7.48 Favored Glycine 0 N--CA 1.508 3.484 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.464 ' CD2' ' HE ' ' A' ' 46' ' ' ARG . 17.0 m80 56.24 110.73 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.653 -0.91 . . . . 0.0 110.736 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.75 -6.47 12.35 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -66.93 -7.75 24.41 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.386 -1.067 . . . . 0.0 109.034 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.35 -42.79 99.68 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -62.44 -43.61 98.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 109.539 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 25.9 mp0 -71.54 -27.9 63.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.312 -0.868 . . . . 0.0 109.395 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 44.7 ttp -67.67 -47.12 70.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.096 -1.002 . . . . 0.0 109.804 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.4 m -72.69 -14.85 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.068 -1.02 . . . . 0.0 109.702 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.32 -26.82 65.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.425 -0.797 . . . . 0.0 109.83 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -80.59 -3.69 51.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.05 -1.031 . . . . 0.0 109.418 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -99.07 110.22 22.84 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 63' ' ' LEU . 92.2 m-20 -64.58 -39.02 92.99 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.403 -0.811 . . . . 0.0 111.325 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -70.27 21.16 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.718 -1.239 . . . . 0.0 111.199 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.8 mt -138.21 131.9 31.01 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.192 -0.942 . . . . 0.0 108.978 178.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 86.8 m -93.43 134.83 35.27 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.322 -0.861 . . . . 0.0 108.689 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.6 t -122.62 131.17 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.473 -0.767 . . . . 0.0 109.244 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.0 tt0 -150.68 153.68 36.05 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.6 pm0 -149.92 154.22 37.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.292 -0.88 . . . . 0.0 109.066 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 70' ' ' ASN . 45.1 t -143.85 132.23 22.09 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.452 -0.78 . . . . 0.0 109.35 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.553 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.8 OUTLIER -64.55 84.0 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' SER . 98.2 m-20 -98.6 142.94 29.55 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.382 -0.824 . . . . 0.0 109.544 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.53 -142.78 42.72 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -100.72 9.6 42.23 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.671 -0.899 . . . . 0.0 109.585 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.442 ' O ' ' ND1' ' A' ' 75' ' ' HIS . 36.6 ttmt -138.16 139.1 39.21 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.34 -0.85 . . . . 0.0 109.971 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.3 tp -66.44 128.95 38.18 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.442 ' ND1' ' O ' ' A' ' 73' ' ' LYS . 64.6 m80 -108.24 104.66 14.11 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.7 m -85.31 150.14 24.97 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.483 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -144.79 149.26 35.17 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.367 -0.833 . . . . 0.0 108.951 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.8 pt -135.08 152.25 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.725 -0.609 . . . . 0.0 109.467 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -141.04 155.81 46.12 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.48 94.31 6.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.877 . . . . 0.0 108.886 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 . . . . . 0 N--CA 1.505 2.309 0 CA-C-O 121.533 0.682 . . . . 0.0 111.03 179.123 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 m170 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -44.85 129.87 9.78 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.651 1.567 . . . . 0.0 112.086 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.99 -41.77 95.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.493 -0.755 . . . . 0.0 109.361 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.462 ' NE2' ' OG1' ' A' ' 14' ' ' THR . 19.9 tm0? -56.33 -48.77 76.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.326 -0.859 . . . . 0.0 109.41 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.01 -34.66 78.21 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttt -62.62 -52.56 62.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.301 -0.874 . . . . 0.0 110.328 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.45 -42.01 75.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.908 -1.12 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.462 ' OG1' ' NE2' ' A' ' 10' ' ' GLN . 97.0 m -61.63 -44.45 96.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.845 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.1 t -61.67 -45.02 95.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.087 -1.008 . . . . 0.0 110.218 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.3 -46.11 51.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.261 -0.899 . . . . 0.0 110.897 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.05 -45.55 98.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.165 -0.959 . . . . 0.0 109.902 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.22 -32.81 72.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.245 -0.909 . . . . 0.0 109.834 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.13 -40.25 94.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.255 -0.903 . . . . 0.0 110.391 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.477 ' C ' ' H ' ' A' ' 22' ' ' ARG . 10.6 m -100.05 6.31 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 O-C-N 121.253 -0.905 . . . . 0.0 109.742 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.0 8.5 0.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.032 -1.043 . . . . 0.0 109.461 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.477 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.5 mtp180 -61.83 -40.5 95.51 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.078 -1.014 . . . . 0.0 109.859 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.502 ' C ' ' HG ' ' A' ' 24' ' ' SER . 37.0 p-10 -73.89 121.43 20.93 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.076 -1.015 . . . . 0.0 109.549 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' C ' ' A' ' 23' ' ' ASP . 96.3 p 47.38 -91.78 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.389 -0.82 . . . . 0.0 110.445 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 23' ' ' ASP . . . -159.41 -59.04 0.01 OUTLIER Glycine 0 N--CA 1.494 2.558 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.432 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 81.9 m95 -55.27 -177.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.396 -1.061 . . . . 0.0 109.872 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.08 135.06 32.19 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.636 -0.665 . . . . 0.0 109.239 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -71.31 134.83 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.257 -0.902 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 tp -55.6 -40.86 72.6 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 109.287 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 t -59.57 -43.8 93.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.112 -0.992 . . . . 0.0 108.991 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.15 86.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.237 -0.914 . . . . 0.0 109.664 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 73.5 t -61.72 -48.86 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.09 -1.006 . . . . 0.0 109.132 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.15 92.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.465 ' HB2' HH21 ' A' ' 46' ' ' ARG . 7.4 t -61.68 -44.28 97.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.859 -1.377 . . . . 0.0 109.832 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.547 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 71.6 t80 -57.98 -43.91 86.83 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.247 -0.908 . . . . 0.0 109.409 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.3 -40.3 96.98 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.337 -0.852 . . . . 0.0 108.992 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.089 -1.007 . . . . 0.0 109.192 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -61.04 -42.52 98.63 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.303 -0.873 . . . . 0.0 109.497 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.547 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.1 m-80 -83.01 -6.07 59.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.275 -0.891 . . . . 0.0 108.714 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -153.69 74.01 6.51 Favored Pre-proline 0 N--CA 1.495 1.799 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.25 -35.31 73.51 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.288 1.992 . . . . 0.0 111.204 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.6 p -66.57 -10.98 50.88 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.539 -0.725 . . . . 0.0 109.415 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -88.36 148.32 24.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.277 -0.889 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -129.45 78.18 76.1 Favored Pre-proline 0 N--CA 1.502 2.145 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 49' ' ' GLY . 41.7 Cg_endo -78.21 -27.3 5.6 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.724 1.616 . . . . 0.0 110.83 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.465 HH21 ' HB2' ' A' ' 34' ' ' SER . 25.2 mmt180 -65.02 -45.25 86.3 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.439 -0.788 . . . . 0.0 109.192 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -48.6 -30.85 5.81 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.319 -0.863 . . . . 0.0 110.295 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 15.0 p-90 -135.62 25.19 3.42 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.252 -0.905 . . . . 0.0 109.829 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -87.43 -11.54 68.81 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -66.5 -40.74 89.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.006 -1.291 . . . . 0.0 109.425 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.646 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . -139.89 -147.94 5.11 Favored Glycine 0 N--CA 1.502 3.073 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.414 HH11 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mtt-85 49.0 -74.84 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 CA-C-N 117.53 0.665 . . . . 0.0 110.535 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.646 ' N ' ' O ' ' A' ' 51' ' ' GLY . 64.7 tp -51.18 -41.67 60.36 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.098 -1.001 . . . . 0.0 108.571 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.1 p -63.98 -29.66 70.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.484 -0.76 . . . . 0.0 109.137 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -85.87 -29.3 23.8 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.265 -0.897 . . . . 0.0 109.562 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.7 mtt -63.61 -41.4 98.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.158 -0.964 . . . . 0.0 109.15 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.7 m -61.47 -41.42 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.242 -0.911 . . . . 0.0 108.93 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.65 -31.98 72.36 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.692 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -89.56 -2.38 58.32 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.109 -0.994 . . . . 0.0 110.417 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 62' ' ' PHE . 6.3 mt -88.09 5.4 41.32 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.203 -0.936 . . . . 0.0 109.196 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.509 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.6 t0 56.55 -75.77 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.781 -0.574 . . . . 0.0 111.793 178.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 60' ' ' LEU . 47.6 p90 -65.52 26.95 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.623 -1.298 . . . . 0.0 111.848 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 61' ' ' ASP . 1.2 mm? -124.86 126.81 46.15 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 120.948 -1.095 . . . . 0.0 108.351 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.1 m -88.45 141.93 28.13 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.54 131.14 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.503 -0.748 . . . . 0.0 109.371 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.432 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -145.53 155.3 42.99 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 38.8 mp0 -114.58 123.95 50.63 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 89.8 p -109.44 150.92 27.38 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 130.54 34.76 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.589 0.709 . . . . 0.0 109.367 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -152.1 112.81 4.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.414 -0.804 . . . . 0.0 109.263 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.41 -144.64 47.41 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.4 p -92.92 1.92 57.05 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.509 -0.994 . . . . 0.0 109.864 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -123.71 135.94 54.16 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.487 -0.758 . . . . 0.0 109.935 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 73.6 mt -75.41 132.42 40.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -104.89 117.03 33.02 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.569 -0.707 . . . . 0.0 109.114 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.0 t -68.12 139.28 56.17 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.371 -0.83 . . . . 0.0 109.476 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -126.26 143.74 51.04 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.9 pt -135.37 158.44 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.742 -0.599 . . . . 0.0 110.07 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -147.98 139.8 23.94 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.38 106.76 0.57 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 109.957 -179.15 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.67 143.47 95.01 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.317 2.012 . . . . 0.0 112.192 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -63.8 -41.2 97.96 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.88 -39.6 81.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.259 -0.901 . . . . 0.0 109.255 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -61.82 -43.54 98.65 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.3 -0.875 . . . . 0.0 109.129 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.2 mtt -63.89 -46.76 83.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.208 -0.933 . . . . 0.0 109.868 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -69.74 -44.12 70.91 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.228 -0.92 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.6 m -63.28 -47.2 83.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.937 . . . . 0.0 110.147 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -66.5 -40.27 89.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 110.133 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.059 -1.026 . . . . 0.0 110.603 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -62.71 -44.45 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.349 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.73 -33.54 75.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 110.063 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 -58.92 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.134 -0.979 . . . . 0.0 110.467 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -98.31 29.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.314 -0.866 . . . . 0.0 109.453 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -48.91 -33.6 11.11 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.011 -1.056 . . . . 0.0 109.659 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.758 ' HG2' HH11 ' A' ' 22' ' ' ARG . 40.8 ttp85 51.92 -87.48 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.466 -0.771 . . . . 0.0 110.605 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 21' ' ' ALA . 95.9 m-20 -60.74 -88.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.892 -1.13 . . . . 0.0 109.989 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 26' ' ' TRP . 31.6 t -167.99 97.95 0.45 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.099 -1.001 . . . . 0.0 109.363 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.5 -25.69 2.38 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.402 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.2 m95 -91.51 142.69 27.38 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.209 -1.171 . . . . 0.0 109.607 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.48 141.7 29.75 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.305 -0.872 . . . . 0.0 108.945 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -67.54 130.36 42.8 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.291 -0.881 . . . . 0.0 109.728 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.72 -39.47 71.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.349 -0.844 . . . . 0.0 109.225 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 t -58.6 -44.0 89.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.098 -1.001 . . . . 0.0 109.173 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.32 87.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.154 -0.966 . . . . 0.0 109.684 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.09 -48.98 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.078 -1.014 . . . . 0.0 109.387 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.47 -44.39 97.73 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -69.64 -40.33 76.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 109.804 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.513 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 70.7 t80 -61.71 -48.52 80.39 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.249 -0.907 . . . . 0.0 109.637 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.0 mt -63.09 -42.14 99.55 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.232 -0.918 . . . . 0.0 108.954 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.64 87.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.907 . . . . 0.0 109.084 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -64.97 -42.85 94.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 109.383 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.513 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.5 m-80 -84.78 -4.64 59.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.171 -0.955 . . . . 0.0 109.352 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 36' ' ' LEU . 7.9 m-20 -154.74 74.24 5.78 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.278 -0.889 . . . . 0.0 108.884 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.0 -35.18 80.09 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.377 2.051 . . . . 0.0 111.286 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.8 t -65.4 -12.47 52.58 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.47 136.12 56.75 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.301 -0.874 . . . . 0.0 108.784 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.438 ' O ' ' ND2' ' A' ' 47' ' ' ASN . 66.2 m-20 -120.45 92.26 47.41 Favored Pre-proline 0 N--CA 1.502 2.141 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.17 -8.31 21.85 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 121.175 1.25 . . . . 0.0 111.49 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.758 HH11 ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -66.85 -41.9 86.63 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.566 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.556 ' O ' ' NH2' ' A' ' 52' ' ' ARG . 17.1 p30 -70.48 -22.09 62.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.528 -0.733 . . . . 0.0 109.549 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.523 ' CE3' ' SD ' ' A' ' 56' ' ' MET . 89.7 m95 -93.61 3.81 54.93 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.131 -0.981 . . . . 0.0 109.112 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.35 138.74 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -68.22 -36.27 79.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.139 -1.212 . . . . 0.0 110.267 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.62 -34.83 5.87 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.556 ' NH2' ' O ' ' A' ' 47' ' ' ASN . 46.3 ttp180 -63.93 -17.51 63.31 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.547 -0.973 . . . . 0.0 109.247 -178.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.3 tp -62.9 -43.05 99.83 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -64.83 -27.6 68.99 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.499 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -80.86 -34.28 33.86 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.139 -0.976 . . . . 0.0 109.4 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.523 ' SD ' ' CE3' ' A' ' 48' ' ' TRP . 47.3 ttp -61.48 -45.75 92.93 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -60.94 -31.3 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.28 -0.888 . . . . 0.0 109.487 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -64.6 -30.65 71.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.349 -0.844 . . . . 0.0 109.896 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -86.94 -7.04 58.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.998 -1.064 . . . . 0.0 110.164 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.7 mt -101.36 127.08 48.16 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.322 -0.861 . . . . 0.0 109.051 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' CG ' ' A' ' 62' ' ' PHE . 97.3 m-20 -65.24 -168.91 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.244 -0.91 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CG ' ' O ' ' A' ' 61' ' ' ASP . 54.5 p90 42.89 16.51 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 122.028 -0.42 . . . . 0.0 111.427 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -132.83 116.37 16.44 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.247 -0.908 . . . . 0.0 108.792 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.407 ' N ' HD13 ' A' ' 63' ' ' LEU . 85.1 m -91.98 141.02 29.08 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.5 t -114.84 130.01 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-O 121.525 0.679 . . . . 0.0 109.621 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -154.23 143.74 21.51 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -108.92 152.25 25.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.646 -0.659 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.5 m -127.38 131.37 50.34 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.605 ' HD3' ' N ' ' A' ' 69' ' ' ARG . 0.1 OUTLIER -77.52 136.63 38.34 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.462 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -149.56 101.2 3.07 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.154 -0.966 . . . . 0.0 109.367 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.73 -141.77 47.81 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.0 p -86.97 -3.97 59.13 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.488 -1.007 . . . . 0.0 109.953 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.508 ' HD2' ' HE2' ' A' ' 75' ' ' HIS . 37.8 ttmt -115.71 121.81 43.62 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.675 -0.641 . . . . 0.0 110.143 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 tt -82.46 130.11 35.04 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.508 ' HE2' ' HD2' ' A' ' 73' ' ' LYS . 38.0 m80 -110.22 124.55 51.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.517 -0.739 . . . . 0.0 109.694 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.5 m -72.01 151.92 42.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.518 -0.739 . . . . 0.0 109.294 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -138.78 151.74 47.33 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.1 pt -137.17 156.45 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.623 0.725 . . . . 0.0 109.525 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -157.81 151.04 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.1 mt -70.33 139.52 52.03 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.221 -0.925 . . . . 0.0 109.935 -179.34 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.506 ' HE2' ' CE ' ' A' ' 12' ' ' MET . 61.4 t60 . . . . . 0 N--CA 1.497 1.905 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.42 142.68 98.66 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.063 1.842 . . . . 0.0 111.752 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.23 -43.34 95.22 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.17 -0.956 . . . . 0.0 109.221 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -65.03 -45.36 85.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.39 -0.819 . . . . 0.0 109.4 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.49 -30.39 70.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.352 -0.842 . . . . 0.0 109.406 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.506 ' CE ' ' HE2' ' A' ' 7' ' ' HIS . 20.8 ttt -61.33 -66.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.307 -0.871 . . . . 0.0 109.803 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.32 -41.94 96.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.0 110.157 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.07 -46.32 89.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.963 -1.086 . . . . 0.0 109.862 -179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.4 m -61.27 -44.69 96.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.021 -1.049 . . . . 0.0 110.201 -179.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.29 -43.55 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.161 -0.962 . . . . 0.0 110.529 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.38 -45.21 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.195 -0.94 . . . . 0.0 109.677 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -67.91 -35.39 78.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.327 -0.858 . . . . 0.0 109.848 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.74 -38.31 90.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.193 -0.942 . . . . 0.0 110.113 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 22' ' ' ARG . 8.3 m -98.4 3.99 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 121.345 -0.847 . . . . 0.0 109.566 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 14.47 0.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.049 -1.032 . . . . 0.0 109.55 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 20' ' ' VAL . 7.2 mtp180 -46.85 164.41 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.143 -0.973 . . . . 0.0 110.684 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -48.66 96.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.574 0.702 . . . . 0.0 110.117 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.7 m -164.77 -70.67 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.362 -0.836 . . . . 0.0 108.87 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 159.52 120.58 0.57 Allowed Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 24.7 m95 45.87 -121.85 1.06 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.552 -0.97 . . . . 0.0 109.995 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -167.45 117.44 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.046 -1.034 . . . . 0.0 108.762 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.57 131.63 49.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.5 -38.28 66.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.4 -0.813 . . . . 0.0 109.448 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -58.48 -43.35 88.94 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.208 -0.932 . . . . 0.0 108.973 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.36 90.79 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.301 -0.875 . . . . 0.0 109.47 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.42 -49.4 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.158 -0.963 . . . . 0.0 109.217 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.41 -48.38 79.06 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.9 m -62.26 -43.18 99.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.298 -1.119 . . . . 0.0 109.85 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -61.29 -45.26 95.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.337 -0.852 . . . . 0.0 109.685 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.79 -41.14 97.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 109.293 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.19 82.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.245 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -65.39 -45.58 83.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -0.916 . . . . 0.0 109.809 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.459 HD22 ' N ' ' A' ' 39' ' ' ASN . 1.4 m-80 -64.6 -40.51 95.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.154 -0.966 . . . . 0.0 109.651 -179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -88.02 160.08 47.07 Favored Pre-proline 0 N--CA 1.501 2.101 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.394 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.41 -38.02 56.03 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.917 1.745 . . . . 0.0 111.416 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.4 m -170.36 76.88 0.08 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.247 -0.908 . . . . 0.0 109.437 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.5 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 37.4 t80 -59.58 169.56 1.28 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.298 -0.876 . . . . 0.0 109.498 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -127.19 76.05 76.53 Favored Pre-proline 0 N--CA 1.503 2.211 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -73.12 -24.02 17.52 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.556 1.504 . . . . 0.0 111.396 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.548 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.5 mtt85 -65.77 -38.77 89.95 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -61.24 -37.82 84.43 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.507 ' HA ' HH21 ' A' ' 52' ' ' ARG . 78.1 m95 -87.78 6.47 35.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.317 -0.864 . . . . 0.0 109.169 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.39 125.01 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -62.63 -12.67 24.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -1.142 . . . . 0.0 109.543 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . -113.87 -43.24 0.81 Allowed Glycine 0 N--CA 1.505 3.281 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.507 HH21 ' HA ' ' A' ' 48' ' ' TRP . 55.3 ttp85 -66.97 -11.47 56.83 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.567 -0.96 . . . . 0.0 108.882 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.66 -42.1 99.43 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.6 p -62.39 -39.08 92.06 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.381 -0.824 . . . . 0.0 109.086 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' O ' ' A' ' 51' ' ' GLY . 3.7 mp0 -72.72 -30.29 64.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.386 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.8 tpt -64.91 -47.43 77.81 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.973 -1.08 . . . . 0.0 109.503 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -72.93 -18.92 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 109.495 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -61.62 -28.79 69.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.456 -0.777 . . . . 0.0 109.789 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -74.52 -1.25 20.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.158 -0.964 . . . . 0.0 109.262 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.8 mt -100.87 119.35 38.55 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.461 -0.775 . . . . 0.0 108.999 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.1 p-10 -74.11 -36.77 64.25 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.234 -0.917 . . . . 0.0 111.417 -179.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -72.15 19.18 0.07 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.703 -1.248 . . . . 0.0 110.978 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.8 mt -136.72 129.59 30.79 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.205 179.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 87.6 m -88.51 133.37 34.17 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 108.778 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -125.72 132.81 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.527 -0.733 . . . . 0.0 109.608 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.548 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 3.3 pt20 -153.62 154.52 34.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -104.41 118.01 35.56 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.357 -0.839 . . . . 0.0 108.822 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 15.3 m -87.62 152.31 22.27 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.71 134.21 36.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.384 -0.822 . . . . 0.0 109.613 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.552 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 38.1 t-20 -150.72 93.57 1.97 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.006 -1.059 . . . . 0.0 109.185 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.54 -141.67 41.5 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.9 t -87.0 -7.7 57.9 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.29 -1.123 . . . . 0.0 109.895 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -106.34 127.88 53.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.404 -0.81 . . . . 0.0 109.742 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.7 mt -75.15 133.53 41.47 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.552 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -106.89 120.37 41.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -74.98 146.36 41.73 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.498 -0.751 . . . . 0.0 109.271 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.03 150.24 41.04 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.365 -0.834 . . . . 0.0 108.927 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.0 pt -140.0 157.22 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 121.467 0.651 . . . . 0.0 109.408 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -149.02 147.93 29.13 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 110.94 16.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.018 -1.051 . . . . 0.0 109.247 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.57 -0.706 . . . . 0.0 109.848 -179.429 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 . . . . . 0 N--CA 1.495 1.815 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -45.45 158.03 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.514 0 C-N-CA 121.62 1.546 . . . . 0.0 112.21 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.478 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.9 mp -62.09 -40.39 95.67 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -54.39 -41.52 69.33 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.25 -0.906 . . . . 0.0 109.294 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -63.32 -42.91 99.02 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.317 -0.864 . . . . 0.0 109.264 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.8 ttt -62.04 -52.21 64.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.009 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -69.14 -42.13 76.38 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.03 -1.043 . . . . 0.0 110.038 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.8 m -62.05 -45.66 92.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.217 -0.927 . . . . 0.0 109.844 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.5 m -60.74 -42.38 97.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 109.7 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.38 95.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 110.354 -179.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 21' ' ' ALA . 96.5 mt -61.93 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.887 -1.133 . . . . 0.0 109.474 -179.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.73 -34.92 78.91 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.198 -0.939 . . . . 0.0 109.565 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.69 -28.59 68.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.102 -0.998 . . . . 0.0 110.08 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 m -136.73 27.93 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.47 -0.769 . . . . 0.0 109.715 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -62.88 -23.26 67.25 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.839 -1.163 . . . . 0.0 109.025 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 55.52 -168.98 0.08 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.247 0.546 . . . . 0.0 110.378 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -58.92 -48.19 82.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.228 -0.92 . . . . 0.0 110.565 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 m -71.65 151.29 43.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.912 -1.117 . . . . 0.0 109.359 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.01 -0.9 66.42 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -100.27 147.66 25.52 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.64 -0.917 . . . . 0.0 109.508 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.0 126.43 39.53 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.481 ' HG3' ' H ' ' A' ' 31' ' ' ALA . 12.8 pt-20 -63.44 138.89 58.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.235 -0.916 . . . . 0.0 109.638 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.597 HD23 ' OG ' ' A' ' 76' ' ' SER . 0.1 OUTLIER -54.31 -38.42 65.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.455 -0.778 . . . . 0.0 109.241 -178.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.6 m -55.91 -44.46 78.27 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 109.628 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.481 ' H ' ' HG3' ' A' ' 28' ' ' GLU . . . -66.38 -38.95 88.69 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.136 -0.978 . . . . 0.0 109.552 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.8 -50.2 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.001 -1.062 . . . . 0.0 109.369 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.09 97.99 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -59.8 -44.21 94.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.179 -1.189 . . . . 0.0 109.493 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -60.97 -47.69 85.29 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.77 -39.67 94.82 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.388 -0.82 . . . . 0.0 109.021 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.7 -45.52 81.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.14 -0.975 . . . . 0.0 109.591 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.1 -48.54 81.29 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.233 -0.917 . . . . 0.0 109.345 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -65.96 -40.19 91.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.309 -0.87 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.03 151.08 75.69 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.223 -0.923 . . . . 0.0 109.185 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -62.3 -35.04 75.87 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.697 1.598 . . . . 0.0 111.57 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.6 m -171.58 80.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.747 -0.596 . . . . 0.0 109.394 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -88.37 -76.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 63.19 91.13 0.08 OUTLIER Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -62.48 -17.55 58.59 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.374 1.383 . . . . 0.0 111.375 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -56.89 -47.46 80.43 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.364 -0.835 . . . . 0.0 109.026 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' A' ' 49' ' ' GLY . 98.1 m-20 -62.12 -33.8 75.14 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 27.1 m95 -75.96 26.55 0.12 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.176 -0.953 . . . . 0.0 109.783 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 51' ' ' GLY . . . 69.45 95.82 0.05 OUTLIER Glycine 0 N--CA 1.492 2.429 0 C-N-CA 119.964 -1.112 . . . . 0.0 110.371 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 49.27 -90.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.41 -1.053 . . . . 0.0 110.457 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 49' ' ' GLY . . . -157.76 62.9 0.32 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -58.7 -5.7 0.62 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.405 -1.056 . . . . 0.0 109.053 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 53' ' ' LEU . 8.9 mp -62.59 -39.48 93.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.3 p -55.89 -33.27 64.46 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.527 -0.733 . . . . 0.0 109.795 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -85.54 -33.58 21.72 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 28.2 ttt -66.03 -43.79 86.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.098 -1.001 . . . . 0.0 109.816 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.62 -22.36 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.187 -0.945 . . . . 0.0 109.81 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -62.55 -21.91 65.93 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.489 -0.757 . . . . 0.0 109.202 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -86.21 6.64 28.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.284 -0.885 . . . . 0.0 109.79 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' PHE . 95.4 mt -93.59 -11.64 31.32 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.11 -0.993 . . . . 0.0 109.41 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 63' ' ' LEU . 22.9 t0 61.3 -61.56 0.09 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.804 -0.56 . . . . 0.0 111.778 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.497 ' N ' ' O ' ' A' ' 60' ' ' LEU . 49.2 p90 -65.82 22.03 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.66 -1.275 . . . . 0.0 112.138 -178.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 61' ' ' ASP . 7.6 mt -136.59 133.27 36.15 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.261 -0.899 . . . . 0.0 109.181 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.6 m -88.11 138.1 31.75 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.1 t -123.65 132.71 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -131.4 132.24 44.23 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -120.58 123.14 42.13 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -109.95 134.2 52.36 Favored 'General case' 0 N--CA 1.507 2.395 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.512 ' HG2' ' NH1' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -72.78 132.61 43.82 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.706 -1.246 . . . . 0.0 108.512 -179.121 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -148.85 91.24 1.84 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.186 -0.946 . . . . 0.0 109.041 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.02 -135.99 28.44 Favored Glycine 0 N--CA 1.489 2.188 0 N-CA-C 109.734 -1.347 . . . . 0.0 109.734 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 87.4 p -86.56 -4.36 59.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.32 -1.106 . . . . 0.0 110.355 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -132.05 136.02 46.92 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.369 -0.832 . . . . 0.0 108.972 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -88.46 158.39 18.37 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 179.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -98.07 103.98 15.97 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.121 -0.987 . . . . 0.0 108.691 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.597 ' OG ' HD23 ' A' ' 29' ' ' LEU . 9.2 t -76.92 150.73 35.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 109.226 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -148.1 137.65 22.3 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.063 -1.023 . . . . 0.0 108.545 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 38.3 pt -117.86 145.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 CA-C-O 121.582 0.706 . . . . 0.0 109.728 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -159.02 142.22 14.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.291 -0.88 . . . . 0.0 108.63 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.8 mt -69.21 137.01 52.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 108.91 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.609 -0.682 . . . . 0.0 110.119 -179.604 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -43.81 152.74 0.32 Allowed 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.804 1.669 . . . . 0.0 112.299 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.9 -40.99 99.26 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.432 -0.793 . . . . 0.0 109.231 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.8 -50.01 75.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -67.68 -30.85 70.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.869 . . . . 0.0 109.69 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 ttt -64.17 -63.97 1.01 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -63.06 -43.13 99.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.142 -0.974 . . . . 0.0 110.071 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.29 -45.87 91.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.4 m -61.93 -44.24 97.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.164 -0.96 . . . . 0.0 110.237 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.5 -46.2 60.37 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.999 -1.063 . . . . 0.0 110.857 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.48 -46.09 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.101 -0.999 . . . . 0.0 109.921 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -67.79 -36.17 79.95 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.362 -0.836 . . . . 0.0 109.671 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.56 93.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.125 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 m -99.55 -0.52 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.305 -0.872 . . . . 0.0 109.952 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.33 -47.17 86.43 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.031 -1.043 . . . . 0.0 108.613 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.413 ' C ' ' H ' ' A' ' 24' ' ' SER . 36.9 mtt180 48.57 34.81 5.28 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.761 0.791 . . . . 0.0 109.987 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 53.48 10.06 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.844 -0.535 . . . . 0.0 109.94 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 22' ' ' ARG . 85.9 p -79.36 165.77 22.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.27 -0.894 . . . . 0.0 109.602 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -56.52 110.33 2.02 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 38.3 m95 46.33 -163.56 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.569 -0.959 . . . . 0.0 110.424 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.82 133.79 40.16 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.53 -0.731 . . . . 0.0 109.179 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -69.15 133.86 48.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.914 . . . . 0.0 109.647 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 36.0 tp -58.38 -39.75 80.46 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.235 -0.916 . . . . 0.0 109.045 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -56.78 -41.3 77.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.254 -0.904 . . . . 0.0 109.257 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.68 88.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.264 -0.898 . . . . 0.0 109.576 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.3 -48.23 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.276 -0.89 . . . . 0.0 109.57 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.71 -46.85 93.37 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.3 m -62.76 -43.26 99.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.19 -1.183 . . . . 0.0 109.877 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE1' ' OD1' ' A' ' 39' ' ' ASN . 58.5 t80 -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 109.655 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.0 mt -63.03 -41.1 99.44 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.294 -0.879 . . . . 0.0 109.168 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.43 -42.67 74.51 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.103 -0.998 . . . . 0.0 109.246 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.93 -42.86 94.31 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.337 -0.852 . . . . 0.0 109.386 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.455 ' OD1' ' CE1' ' A' ' 35' ' ' TYR . 8.2 m120 -88.9 6.5 38.95 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.325 -0.859 . . . . 0.0 109.492 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 36' ' ' LEU . 39.6 t0 -144.94 79.44 11.98 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.36 -0.837 . . . . 0.0 108.8 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -60.57 156.32 42.77 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.197 1.931 . . . . 0.0 111.865 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 p 70.43 -2.98 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.509 -0.744 . . . . 0.0 109.384 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -83.0 134.72 35.04 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.102 -0.999 . . . . 0.0 109.201 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.97 88.32 44.57 Favored Pre-proline 0 N--CA 1.502 2.129 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -54.24 -35.16 82.28 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 121.856 1.704 . . . . 0.0 110.633 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 47.7 mmm-85 -60.19 -36.93 78.74 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.071 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 49' ' ' GLY . 6.4 m120 -63.3 -37.16 86.16 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.114 -0.991 . . . . 0.0 108.697 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -76.89 19.17 0.3 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.568 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 88.11 156.19 30.24 Favored Glycine 0 N--CA 1.501 2.97 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ARG . 58.6 t-80 -78.48 111.64 14.72 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.316 -1.108 . . . . 0.0 109.703 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 57.35 6.1 2.02 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' HIS . 40.2 ttp180 -65.46 -1.02 2.2 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.288 -1.125 . . . . 0.0 109.145 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.475 HD12 ' N ' ' A' ' 53' ' ' LEU . 10.3 mp -62.66 -38.67 91.22 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.7 p -55.24 -33.08 62.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -80.1 -35.96 36.1 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.049 -1.032 . . . . 0.0 109.379 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 tpt -65.42 -45.63 83.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.067 -1.02 . . . . 0.0 109.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.38 -23.86 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.066 -1.021 . . . . 0.0 109.662 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -67.43 -21.69 65.55 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.525 -0.734 . . . . 0.0 109.856 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -91.75 -8.22 47.46 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.072 -1.018 . . . . 0.0 110.543 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mt -94.19 -7.21 42.86 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.986 -1.071 . . . . 0.0 108.197 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 46.86 55.15 8.21 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.742 -0.598 . . . . 0.0 110.931 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -151.51 9.28 0.54 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.892 -1.13 . . . . 0.0 110.575 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mt -137.84 149.03 45.97 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 71.7 m -86.72 122.92 31.3 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.4 t -111.51 118.72 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -144.25 142.63 30.59 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -94.43 152.43 18.61 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.35 -0.844 . . . . 0.0 109.394 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 131.11 21.64 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -73.35 130.49 40.28 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -152.46 155.04 36.72 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 109.618 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.15 -131.18 51.92 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.1 m -113.76 8.68 17.51 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.843 -0.798 . . . . 0.0 109.588 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -147.57 153.56 39.59 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.995 . . . . 0.0 110.061 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.6 tp -63.43 136.95 57.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.486 -0.759 . . . . 0.0 109.237 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -121.88 134.55 54.87 Favored 'General case' 0 N--CA 1.505 2.299 0 CA-C-O 121.644 0.735 . . . . 0.0 109.231 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.4 p -77.86 158.01 29.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.523 -0.736 . . . . 0.0 109.28 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -144.9 144.59 31.17 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 pt -133.07 151.51 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.723 -0.611 . . . . 0.0 109.448 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -155.32 150.54 26.94 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.547 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -64.01 131.64 48.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.896 . . . . 0.0 108.609 -179.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.547 ' N ' HD13 ' A' ' 80' ' ' LEU . 12.0 ptp180 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.02 -1.05 . . . . 0.0 109.941 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -54.68 146.41 54.72 Favored 'Trans proline' 0 N--CA 1.499 1.811 0 C-N-CA 121.731 1.62 . . . . 0.0 112.135 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.23 -41.89 98.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.281 -0.887 . . . . 0.0 108.979 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -59.57 -39.84 85.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 0.0 109.088 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.17 -37.14 86.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.12 -0.988 . . . . 0.0 108.698 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 93.5 mtp -61.22 -48.01 83.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 109.841 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -68.97 -42.02 77.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.228 -0.92 . . . . 0.0 109.913 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 m -62.55 -50.11 72.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.015 -1.053 . . . . 0.0 110.009 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -66.37 -42.62 87.73 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.326 -0.859 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.1 65.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.154 -0.966 . . . . 0.0 111.526 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 93.0 mt -62.88 -44.61 99.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.838 -1.164 . . . . 0.0 109.584 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -66.37 -30.21 70.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.159 -0.963 . . . . 0.0 109.481 -179.897 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -48.48 75.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.132 -0.98 . . . . 0.0 110.721 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.46 18.01 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 121.352 -0.843 . . . . 0.0 109.841 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.507 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -60.45 -38.58 84.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 109.441 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 22' ' ' ARG . 32.6 mtm180 51.0 72.06 0.39 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 110.773 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 51.78 36.8 18.75 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.429 -0.794 . . . . 0.0 110.203 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.507 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 46.5 m -162.51 121.26 2.2 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.077 -1.014 . . . . 0.0 108.836 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.37 0.68 3.56 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.424 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.3 m95 -99.7 145.93 27.08 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.505 -0.997 . . . . 0.0 108.95 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.01 143.85 31.39 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 35.3 mp0 -68.72 132.39 46.75 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.003 -1.061 . . . . 0.0 109.369 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -55.09 -40.62 70.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.117 -0.989 . . . . 0.0 109.287 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -58.51 -43.76 89.24 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.249 -0.907 . . . . 0.0 108.909 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.03 -37.62 88.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.347 -0.845 . . . . 0.0 109.799 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.0 t -62.05 -49.5 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.11 -43.92 98.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.994 -1.243 . . . . 0.0 109.994 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.1 t -62.69 -45.18 93.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.001 -1.293 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 86.8 t80 -60.96 -48.48 81.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 109.499 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.71 -39.29 93.4 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.426 -0.796 . . . . 0.0 109.112 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.51 82.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.314 -0.866 . . . . 0.0 109.03 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.51 -44.15 91.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.639 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.8 m-80 -64.58 -40.33 95.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.279 -0.888 . . . . 0.0 110.371 -179.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.84 153.21 42.1 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.194 -0.941 . . . . 0.0 109.422 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -47.69 -43.72 27.87 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.19 1.26 . . . . 0.0 111.73 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.2 m -168.97 77.71 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.517 ' CG ' ' N ' ' A' ' 44' ' ' ASP . 45.6 t80 -60.03 -176.19 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.172 -0.955 . . . . 0.0 109.582 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.517 ' N ' ' CG ' ' A' ' 43' ' ' PHE . 3.6 m-20 -145.72 87.97 6.67 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -80.71 -92.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 121.646 1.564 . . . . 0.0 111.245 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.445 ' C ' ' H ' ' A' ' 48' ' ' TRP . 10.3 ptm180 -66.9 -22.3 65.97 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.005 -1.059 . . . . 0.0 109.898 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -51.14 -10.34 0.08 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.072 -1.017 . . . . 0.0 109.795 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.508 ' CD1' ' O ' ' A' ' 44' ' ' ASP . 10.1 m0 -76.59 -25.96 54.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.188 -0.945 . . . . 0.0 108.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 168.06 -168.17 40.62 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -74.45 76.79 1.92 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.391 -1.064 . . . . 0.0 109.787 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.03 17.98 79.18 Favored Glycine 0 N--CA 1.498 2.831 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.493 HH11 ' HG2' ' A' ' 52' ' ' ARG . 75.8 ttt-85 -62.51 -19.03 63.19 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.267 -1.137 . . . . 0.0 108.935 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.32 -44.14 97.18 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -63.03 -35.03 78.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.543 -0.723 . . . . 0.0 109.213 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -77.5 -29.19 52.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.31 -0.868 . . . . 0.0 109.5 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.3 ttp -62.9 -46.4 88.02 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.284 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.67 -30.07 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.196 -0.94 . . . . 0.0 109.554 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.3 -35.95 78.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.187 -0.946 . . . . 0.0 109.8 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -64.34 -35.43 80.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 108.874 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -75.48 138.87 41.88 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.672 -0.642 . . . . 0.0 109.281 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -87.57 -32.72 19.2 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.408 -0.808 . . . . 0.0 111.324 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -76.29 18.0 0.33 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.911 -1.118 . . . . 0.0 110.764 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.35 127.82 32.44 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.465 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 86.0 m -92.08 135.39 34.01 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.2 t -109.88 130.94 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.483 -0.76 . . . . 0.0 109.146 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -153.4 157.12 39.48 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.0 pm0 -145.86 155.81 43.13 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.051 -1.031 . . . . 0.0 108.558 -179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 66.1 m -132.4 147.62 52.39 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.685 ' HG3' HH11 ' A' ' 69' ' ' ARG . 9.0 mtm-85 -76.52 140.91 41.34 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.394 0.616 . . . . 0.0 109.79 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -150.94 100.71 2.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.442 -0.786 . . . . 0.0 109.684 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 64.61 -139.09 40.89 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.3 p -89.29 4.62 48.21 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.398 -1.06 . . . . 0.0 109.868 -179.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -139.38 114.64 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.468 -0.77 . . . . 0.0 109.542 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -76.06 141.29 42.09 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -102.92 123.07 45.85 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.545 -0.722 . . . . 0.0 109.434 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.8 m -71.18 149.8 45.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.472 -0.768 . . . . 0.0 109.057 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -139.64 153.42 47.31 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 pt -141.39 156.45 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt-85 -137.84 147.96 45.0 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.26 117.9 29.35 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.465 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 92.6 mtt-85 . . . . . 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 110.184 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.539 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.048 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 22.1 Cg_exo -62.45 143.39 93.24 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 122.144 1.896 . . . . 0.0 112.145 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -65.26 -42.02 93.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.383 -0.823 . . . . 0.0 109.233 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.28 -43.75 97.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 109.607 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.26 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' HD22 ' A' ' 36' ' ' LEU . 39.8 tpp -61.58 -53.84 51.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.294 -0.879 . . . . 0.0 109.814 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -70.16 -40.66 74.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.193 -0.942 . . . . 0.0 109.999 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -62.63 -45.55 92.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.068 -1.02 . . . . 0.0 109.661 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -60.17 -45.03 94.46 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.202 -0.936 . . . . 0.0 110.07 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.46 -48.06 43.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.232 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.57 -44.61 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.126 -0.983 . . . . 0.0 109.475 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -66.27 -33.51 75.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.209 -0.932 . . . . 0.0 109.889 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.38 -59.15 3.63 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.182 -0.949 . . . . 0.0 110.706 -179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -96.72 29.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.345 -0.847 . . . . 0.0 109.918 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.75 -20.49 2.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.974 -1.079 . . . . 0.0 109.97 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.639 ' HG3' HH11 ' A' ' 22' ' ' ARG . 3.7 ttt85 60.21 43.4 13.98 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.594 -0.691 . . . . 0.0 109.24 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 41.58 37.49 0.72 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.782 -0.574 . . . . 0.0 111.192 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.6 p -143.82 9.32 1.53 Allowed 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.173 -0.954 . . . . 0.0 109.39 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.87 -43.73 0.98 Allowed Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.437 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 99.4 m95 -75.17 174.87 8.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.3 -1.117 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.35 145.43 22.75 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -71.28 127.44 32.56 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.468 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.03 -42.21 68.89 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.125 -0.984 . . . . 0.0 109.512 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -60.13 -43.29 95.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.227 -0.921 . . . . 0.0 109.069 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.02 81.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.75 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.79 -49.04 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.965 -1.084 . . . . 0.0 109.6 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.66 -49.56 77.3 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.3 m -64.98 -42.22 94.74 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.288 -1.125 . . . . 0.0 110.017 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.449 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 63.5 t80 -60.56 -49.3 78.08 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.258 -0.901 . . . . 0.0 109.558 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.486 ' O ' ' N ' ' A' ' 40' ' ' ASP . 91.6 mt -63.1 -41.95 99.48 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.299 -0.876 . . . . 0.0 109.029 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.62 86.88 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.885 . . . . 0.0 109.288 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.5 -42.89 95.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.435 -0.79 . . . . 0.0 109.678 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.449 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.3 m-80 -85.14 -2.93 58.58 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.226 -0.921 . . . . 0.0 109.531 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 36' ' ' LEU . 23.9 t70 -161.14 75.79 2.5 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.83 -27.34 52.53 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.141 1.894 . . . . 0.0 111.071 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 m -66.37 -8.21 24.08 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.566 -0.709 . . . . 0.0 109.397 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -69.31 134.23 48.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.352 -0.842 . . . . 0.0 109.254 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -117.85 91.04 38.16 Favored Pre-proline 0 N--CA 1.504 2.239 0 O-C-N 121.815 -0.553 . . . . 0.0 109.85 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.04 -17.34 30.85 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.148 1.899 . . . . 0.0 111.021 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 46' ' ' ARG . 78.4 mtt180 -63.98 -35.63 81.32 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.613 0.72 . . . . 0.0 109.229 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -61.36 -36.1 79.26 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CD1' ' N ' ' A' ' 48' ' ' TRP . 48.4 m95 -77.99 3.59 14.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 50' ' ' HIS . . . 70.36 -1.71 18.58 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' ARG . 72.9 t60 59.1 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.822 -0.81 . . . . 0.0 109.923 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.505 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 68.91 -65.24 0.48 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.536 HH11 ' HG3' ' A' ' 52' ' ' ARG . 85.2 mtm-85 -59.58 2.45 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.68 -0.894 . . . . 0.0 109.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 51' ' ' GLY . 59.1 tp -57.77 -41.04 81.18 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.984 -1.073 . . . . 0.0 108.511 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -60.93 -41.97 97.25 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 108.946 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.9 mm-40 -71.52 -30.22 65.68 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.874 -1.141 . . . . 0.0 109.796 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.9 mmm -63.17 -42.99 99.49 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.873 -1.142 . . . . 0.0 109.544 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.0 m -73.55 -22.92 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.089 -1.007 . . . . 0.0 109.734 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -61.92 -39.08 90.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.046 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -98.2 56.77 1.21 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.371 -0.83 . . . . 0.0 110.003 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 mt -146.14 -6.32 0.57 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.508 ' O ' ' N ' ' A' ' 63' ' ' LEU . 23.0 t70 62.68 -174.15 0.15 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.344 -0.847 . . . . 0.0 110.134 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.488 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 31.1 p90 40.72 20.05 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.592 0 CA-C-O 121.295 0.569 . . . . 0.0 110.904 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.3 mt -141.97 131.63 24.07 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.214 -0.929 . . . . 0.0 109.472 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 81' ' ' ARG . 98.5 m -101.37 134.57 44.25 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.78 131.95 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 O-C-N 121.671 -0.643 . . . . 0.0 109.439 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.437 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 88.8 mt-30 -137.65 149.62 46.73 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -140.21 136.23 33.19 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.0 p -132.88 152.46 51.86 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.54 ' NH1' ' HG2' ' A' ' 69' ' ' ARG . 2.8 mtt-85 -89.11 130.66 35.52 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 75' ' ' HIS . 14.4 p-10 -150.31 114.45 5.11 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.019 -1.051 . . . . 0.0 109.619 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.4 -137.16 34.84 Favored Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.3 p -93.47 -0.95 56.21 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.314 -1.109 . . . . 0.0 110.248 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 68.5 mttm -134.81 139.35 45.03 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.376 -0.828 . . . . 0.0 109.684 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.65 151.08 37.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.232 -0.918 . . . . 0.0 109.077 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.47 ' CG ' ' OE2' ' A' ' 77' ' ' GLU . 19.5 t-160 -100.25 100.9 11.78 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.7 p -83.92 151.91 24.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.432 -0.793 . . . . 0.0 108.901 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.472 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 53.9 mp0 -146.44 153.59 40.63 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 pt -133.16 150.82 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 CA-C-O 121.398 0.618 . . . . 0.0 109.746 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -151.72 154.17 35.79 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 81' ' ' ARG . 60.4 mt -64.03 153.29 37.82 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.579 -0.701 . . . . 0.0 109.401 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 80' ' ' LEU . 9.0 tpp180 . . . . . 0 N--CA 1.509 2.512 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m80 . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -46.06 139.03 12.06 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.713 1.608 . . . . 0.0 112.221 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.488 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.2 mp -63.08 -41.6 99.45 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.326 -0.859 . . . . 0.0 108.798 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -57.96 -38.51 76.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 109.153 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -63.09 -42.13 99.55 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.17 -0.956 . . . . 0.0 109.451 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.5 mmm -63.5 -47.41 81.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.677 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -72.65 -43.86 62.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.094 -1.003 . . . . 0.0 110.163 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.54 -50.14 72.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.122 -0.986 . . . . 0.0 110.331 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.3 m -64.84 -42.33 94.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.37 -0.831 . . . . 0.0 110.254 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.18 48.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.54 -44.29 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 109.861 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -65.43 -33.82 76.84 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.73 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -39.43 93.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.012 . . . . 0.0 110.027 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.29 16.91 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.448 -0.782 . . . . 0.0 110.038 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.1 11.41 9.78 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.966 -1.084 . . . . 0.0 108.774 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HD3' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -46.71 143.53 2.72 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.382 -0.823 . . . . 0.0 110.7 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 t0 56.05 24.66 8.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.848 -0.533 . . . . 0.0 110.169 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.0 m 51.65 -153.53 0.19 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.976 -1.078 . . . . 0.0 109.921 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.82 56.57 4.07 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.491 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 36.6 m95 42.57 -139.48 0.18 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.779 -0.836 . . . . 0.0 110.624 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.71 138.52 11.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.022 -1.048 . . . . 0.0 108.692 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.87 125.37 28.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.127 -0.983 . . . . 0.0 109.286 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.447 HD13 ' O ' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -54.29 -39.27 66.79 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.346 -0.846 . . . . 0.0 109.104 -178.201 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.1 t -59.94 -43.94 94.68 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.777 -1.202 . . . . 0.0 108.885 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.29 -40.7 94.17 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.0 t -63.47 -51.0 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.132 -0.98 . . . . 0.0 109.678 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.67 -41.85 99.77 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.21 -44.43 96.59 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.15 -1.206 . . . . 0.0 109.694 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.559 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 76.9 t80 -57.45 -43.34 83.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 109.353 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.0 mt -63.29 -38.16 90.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.916 . . . . 0.0 108.93 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.69 -46.69 70.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.009 -1.057 . . . . 0.0 109.708 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -63.37 -40.17 96.52 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.081 -1.012 . . . . 0.0 109.174 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.559 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 80.1 m-20 -90.46 7.2 40.02 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.074 -1.016 . . . . 0.0 109.297 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.2 t0 -164.71 57.83 0.56 Allowed Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 108.884 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 43' ' ' PHE . 27.7 Cg_endo -60.9 174.09 1.93 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 122.091 1.86 . . . . 0.0 111.947 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 m 66.36 -6.61 0.48 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' A' ' 41' ' ' PRO . 47.8 t80 -94.41 -74.44 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.093 -1.004 . . . . 0.0 108.665 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.1 t0 63.91 91.51 0.08 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.432 ' O ' ' N ' ' A' ' 49' ' ' GLY . 51.2 Cg_exo -54.02 -38.32 86.78 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.84 1.694 . . . . 0.0 111.653 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -55.43 -39.11 69.86 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.602 -0.686 . . . . 0.0 109.916 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -49.8 -44.25 49.01 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.924 -1.11 . . . . 0.0 110.454 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.456 ' NE1' ' CZ ' ' A' ' 43' ' ' PHE . 49.0 p-90 -116.22 16.25 15.88 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.521 -0.737 . . . . 0.0 109.222 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -161.38 62.53 0.28 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.485 ' C ' ' H ' ' A' ' 52' ' ' ARG . 49.9 t-80 -69.27 98.9 1.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.515 -0.991 . . . . 0.0 109.1 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.84 -38.92 0.24 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.049 -1.221 . . . . 0.0 110.049 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 50' ' ' HIS . 83.6 mtm-85 -66.9 -1.62 4.22 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -1.178 . . . . 0.0 109.442 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.32 -42.18 99.16 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.9 p -62.05 -27.48 68.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.24 -0.912 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -81.87 -34.88 29.84 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -62.44 -41.07 98.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.248 -0.908 . . . . 0.0 109.53 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.83 -9.07 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.384 -0.822 . . . . 0.0 109.766 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -58.75 -30.76 67.75 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.158 -0.963 . . . . 0.0 109.698 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.22 -7.63 48.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.068 -1.02 . . . . 0.0 108.984 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.9 mt -93.82 110.63 22.27 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.96 -1.088 . . . . 0.0 108.891 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.445 ' C ' ' H ' ' A' ' 63' ' ' LEU . 67.1 t0 -65.09 -37.84 88.82 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.345 -0.847 . . . . 0.0 111.133 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -70.98 20.18 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.772 -1.205 . . . . 0.0 111.262 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 61' ' ' ASP . 10.5 mt -138.07 125.64 22.12 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.222 -0.924 . . . . 0.0 108.839 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 84.0 m -87.8 142.44 27.81 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.397 -0.814 . . . . 0.0 108.883 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.6 t -117.17 129.53 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.491 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 49.3 tt0 -155.9 155.93 33.72 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 1.8 pm0 -144.94 146.42 31.97 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.117 -0.989 . . . . 0.0 110.199 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.1 m -167.23 152.39 7.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.311 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.53 170.63 4.08 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.59 167.77 17.8 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 122.198 0.999 . . . . 0.0 111.056 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.69 -150.3 42.47 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.9 p -96.44 6.92 47.75 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.47 -1.018 . . . . 0.0 109.271 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -87.77 150.62 23.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.079 -1.013 . . . . 0.0 109.504 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -123.86 122.9 39.21 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -91.13 137.19 32.56 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.327 -0.858 . . . . 0.0 108.907 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 m -71.21 140.89 50.62 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.811 -1.181 . . . . 0.0 109.13 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -149.87 136.43 19.17 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.271 -0.893 . . . . 0.0 109.144 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 O-C-N 121.339 -0.851 . . . . 0.0 109.8 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -144.32 145.95 32.3 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.532 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -74.17 138.66 43.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.28 -0.887 . . . . 0.0 108.947 -179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.532 ' H ' HD13 ' A' ' 80' ' ' LEU . 12.7 tpt180 . . . . . 0 C--N 1.301 -1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.756 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.52 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.179 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 16.2 Cg_exo -66.13 140.73 60.62 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.346 2.03 . . . . 0.0 111.928 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 9' ' ' LEU . 9.9 mp -64.79 -43.59 92.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.148 -0.97 . . . . 0.0 109.346 179.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -63.48 -46.86 84.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.124 -0.985 . . . . 0.0 110.056 -179.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.82 -34.87 79.15 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.163 -0.96 . . . . 0.0 109.608 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.7 ttt -60.9 -51.98 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.142 -0.974 . . . . 0.0 109.982 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -69.7 -39.73 76.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.999 -1.063 . . . . 0.0 109.748 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.8 m -60.4 -45.24 94.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.025 -1.047 . . . . 0.0 109.641 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.3 p -61.94 -42.95 99.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.212 -0.93 . . . . 0.0 110.12 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.85 -46.05 55.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.061 -1.024 . . . . 0.0 110.843 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.49 -46.6 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.046 -1.034 . . . . 0.0 109.723 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -67.83 -34.19 76.24 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 109.843 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.84 92.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.334 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -100.46 5.74 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.317 -0.865 . . . . 0.0 109.702 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -67.14 -7.7 25.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.013 -1.054 . . . . 0.0 108.877 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -61.91 81.38 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.218 -0.926 . . . . 0.0 109.933 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 21' ' ' ALA . 34.7 t70 -173.54 -50.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.0 t -168.87 -30.69 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.772 . . . . 0.0 109.505 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.38 -64.08 0.33 Allowed Glycine 0 N--CA 1.498 2.809 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.546 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 94.2 m95 -54.28 -174.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -1.137 . . . . 0.0 110.166 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.3 136.64 14.03 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.375 -0.828 . . . . 0.0 108.86 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 56.5 mp0 -73.78 132.03 42.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.286 -0.884 . . . . 0.0 109.684 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.24 -40.81 74.73 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.329 -0.857 . . . . 0.0 109.172 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -57.09 -42.92 81.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.036 -1.04 . . . . 0.0 109.111 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.32 90.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 92.9 t -63.13 -48.84 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 109.542 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.73 97.32 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -68.39 -42.01 79.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -1.179 . . . . 0.0 109.892 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 67.7 t80 -61.64 -47.9 83.31 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.152 -0.967 . . . . 0.0 109.57 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.08 -40.82 98.8 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.236 -0.915 . . . . 0.0 108.753 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.34 77.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.104 -0.998 . . . . 0.0 109.512 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -61.63 -46.43 89.85 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.992 -1.068 . . . . 0.0 109.371 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.537 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.7 m-80 -65.15 -39.29 92.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -0.922 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.45 82.99 44.57 Favored Pre-proline 0 N--CA 1.502 2.128 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.27 -29.69 68.45 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.382 2.055 . . . . 0.0 111.1 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 m -67.63 -7.91 30.38 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.544 -0.723 . . . . 0.0 109.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -88.96 123.07 32.96 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.383 -0.823 . . . . 0.0 108.785 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -124.93 82.26 61.29 Favored Pre-proline 0 N--CA 1.502 2.153 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.505 ' O ' ' N ' ' A' ' 49' ' ' GLY . 34.1 Cg_endo -75.59 -33.64 3.89 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 C-N-CA 121.579 1.519 . . . . 0.0 110.947 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.605 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.6 mtt85 -62.85 -43.61 98.34 Favored 'General case' 0 N--CA 1.492 1.656 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -48.22 -31.53 5.93 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -178.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.8 p-90 -133.42 24.81 4.12 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -169.87 55.9 0.2 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -60.32 -47.2 87.03 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.359 -1.083 . . . . 0.0 109.48 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.51 -29.57 0.42 Allowed Glycine 0 N--CA 1.504 3.193 0 N-CA-C 109.112 -1.595 . . . . 0.0 109.112 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -5.1 2.66 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.369 -1.077 . . . . 0.0 109.177 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.27 -39.47 93.01 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 0.0 108.796 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.4 t -59.22 -39.9 84.15 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.366 -0.834 . . . . 0.0 109.371 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -75.83 -26.85 57.57 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.089 -1.007 . . . . 0.0 109.886 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.4 mmt -64.73 -43.21 94.11 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.775 -1.203 . . . . 0.0 109.633 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.413 HG22 ' H ' ' A' ' 57' ' ' VAL . 15.9 m -69.99 -22.39 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.236 -0.915 . . . . 0.0 109.62 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -62.69 -30.8 71.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 109.355 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -63.22 -34.25 77.25 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.206 -0.934 . . . . 0.0 109.272 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.97 116.05 14.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.356 -0.84 . . . . 0.0 109.334 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.453 ' C ' ' H ' ' A' ' 63' ' ' LEU . 90.0 m-20 -64.57 -40.78 96.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.538 -0.726 . . . . 0.0 111.596 -178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -70.57 19.03 0.05 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.634 -1.291 . . . . 0.0 111.349 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.453 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.9 mt -136.39 122.25 19.97 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.33 -0.856 . . . . 0.0 109.05 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 97.5 m -91.55 137.65 32.2 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.63 128.23 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.617 -0.677 . . . . 0.0 109.835 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.546 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 26.7 mt-30 -145.06 146.42 31.85 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 55.4 mp0 -95.92 148.49 22.57 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -127.82 140.23 52.16 Favored 'General case' 0 N--CA 1.503 2.197 0 CA-C-O 121.677 0.751 . . . . 0.0 109.498 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.646 HH11 ' HG2' ' A' ' 69' ' ' ARG . 3.3 mmt-85 -77.01 131.54 38.51 Favored 'General case' 0 N--CA 1.497 1.897 0 CA-C-O 121.42 0.629 . . . . 0.0 109.796 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -149.01 101.51 3.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.537 -0.727 . . . . 0.0 110.298 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 59.03 -142.62 46.35 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.8 t -85.68 1.46 49.28 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -1.202 . . . . 0.0 110.15 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -139.04 117.11 11.73 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.359 -0.838 . . . . 0.0 109.564 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -73.97 174.1 9.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.508 -0.745 . . . . 0.0 109.033 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -144.24 137.67 27.47 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.206 -0.934 . . . . 0.0 109.574 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.2 t -70.22 150.41 46.46 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.488 -0.757 . . . . 0.0 109.402 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -134.94 150.81 50.44 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 pt -132.72 152.61 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -149.96 152.49 35.04 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.04 109.26 14.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.161 -0.962 . . . . 0.0 109.043 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.47 -0.769 . . . . 0.0 110.016 -179.584 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.499 2.001 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 144.62 98.91 Favored 'Trans proline' 0 N--CA 1.499 1.845 0 C-N-CA 121.854 1.703 . . . . 0.0 111.882 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.6 mt -63.99 -42.13 97.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.432 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -64.79 -45.91 84.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.882 . . . . 0.0 109.594 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -66.11 -27.16 67.84 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.271 -0.893 . . . . 0.0 109.15 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.474 ' SD ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -67.5 -63.73 1.0 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.474 -0.766 . . . . 0.0 110.309 -179.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -61.89 -45.81 92.11 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.213 -0.929 . . . . 0.0 110.542 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.3 p -59.81 -44.06 94.19 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.995 -1.066 . . . . 0.0 110.408 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 t -61.11 -46.07 92.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.914 -1.117 . . . . 0.0 110.145 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.97 -48.39 45.31 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.386 -0.822 . . . . 0.0 110.837 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.417 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 91.5 mt -61.57 -48.07 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.132 -0.98 . . . . 0.0 109.711 -178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -66.91 -25.12 66.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 109.546 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.94 -32.73 51.68 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.024 -1.048 . . . . 0.0 110.564 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ARG . 5.9 m -108.32 -0.41 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.959 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -71.82 16.08 0.13 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.915 -1.116 . . . . 0.0 109.081 179.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.8 mtp180 -48.77 -13.02 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.881 -1.137 . . . . 0.0 110.422 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 21' ' ' ALA . 25.6 p30 -74.22 -5.89 44.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.241 -0.912 . . . . 0.0 109.339 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p 68.8 40.45 1.73 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.475 -0.766 . . . . 0.0 109.194 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.74 -140.37 4.12 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -54.63 -170.33 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.902 . . . . 0.0 110.064 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.28 139.76 20.52 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.221 -0.924 . . . . 0.0 108.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -69.93 128.04 34.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 109.343 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.5 -39.27 83.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.427 -0.795 . . . . 0.0 109.186 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.0 m -55.68 -43.82 76.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.921 -1.112 . . . . 0.0 109.402 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.93 -37.88 89.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.319 -0.863 . . . . 0.0 109.205 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 75.7 t -62.92 -48.55 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.219 -0.925 . . . . 0.0 109.74 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.19 -44.93 97.03 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 t -62.98 -45.06 94.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.222 -1.164 . . . . 0.0 109.953 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -61.04 -48.77 80.21 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.985 -1.072 . . . . 0.0 109.438 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 40' ' ' ASP . 93.0 mt -65.01 -41.18 95.56 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.216 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.36 -45.69 80.36 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.871 -1.143 . . . . 0.0 109.631 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -64.65 -42.3 95.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -0.884 . . . . 0.0 110.095 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -86.67 -4.56 59.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.08 -1.013 . . . . 0.0 109.689 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 36' ' ' LEU . 16.4 m-20 -154.48 63.76 4.22 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.428 ' C ' ' H ' ' A' ' 43' ' ' PHE . 13.6 Cg_endo -54.76 -166.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.739 1.626 . . . . 0.0 111.859 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t 69.36 -6.24 1.0 Allowed 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -178.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 41' ' ' PRO . 1.6 t80 -77.51 135.68 38.25 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.234 -0.916 . . . . 0.0 108.661 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -123.82 84.6 54.1 Favored Pre-proline 0 N--CA 1.503 2.218 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -62.56 -25.35 75.55 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 121.905 1.737 . . . . 0.0 110.649 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 48' ' ' TRP . 47.7 mmm-85 -66.57 -37.74 85.59 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.951 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -55.55 -7.6 0.28 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.444 -0.785 . . . . 0.0 110.052 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.416 ' H ' ' C ' ' A' ' 46' ' ' ARG . 65.3 m95 -97.27 -15.79 20.64 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.136 -0.977 . . . . 0.0 109.613 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 48' ' ' TRP . . . 49.76 101.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.643 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 82.1 t60 51.03 84.4 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.096 -1.237 . . . . 0.0 110.469 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 159.33 -57.36 0.33 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 45.4 mtm180 48.29 -133.19 1.39 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.487 -1.008 . . . . 0.0 110.225 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 53' ' ' LEU . 10.3 mp -63.78 -36.57 84.34 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -49.57 -31.2 9.97 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.554 -0.716 . . . . 0.0 109.377 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -82.69 -40.66 20.33 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 33.6 tpp -62.4 -46.99 86.09 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.191 -0.943 . . . . 0.0 109.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.6 m -64.64 -35.37 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.082 -1.011 . . . . 0.0 109.615 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -57.45 -42.64 82.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 -179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -67.24 -44.37 79.62 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.025 -1.047 . . . . 0.0 109.262 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.3 mt -75.56 143.26 42.51 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.444 -0.785 . . . . 0.0 109.94 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 63' ' ' LEU . 71.4 m-20 -92.85 -150.86 0.28 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.335 -0.853 . . . . 0.0 109.913 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 54.4 p90 42.45 19.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.527 -0.733 . . . . 0.0 111.17 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 61' ' ' ASP . 15.7 mt -132.52 130.07 39.93 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.567 -0.708 . . . . 0.0 109.543 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 88.7 m -89.38 134.63 33.99 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 53.3 t -120.19 130.55 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.317 0 O-C-N 121.553 -0.717 . . . . 0.0 109.109 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -151.25 118.73 6.04 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -124.25 135.73 53.62 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.661 0.743 . . . . 0.0 109.705 -178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.7 t -100.23 125.23 46.38 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 mtt180 -68.73 135.59 51.52 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.026 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -150.0 103.89 3.24 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.483 -0.761 . . . . 0.0 109.737 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.74 -142.49 43.56 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 33.3 t -84.74 -9.03 58.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.284 -1.127 . . . . 0.0 110.247 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -121.45 116.55 24.95 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -89.7 151.17 21.99 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.955 -1.09 . . . . 0.0 108.519 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -99.77 99.95 10.84 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.364 -0.835 . . . . 0.0 109.066 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.5 t -75.37 146.58 40.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.407 -0.808 . . . . 0.0 109.217 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -142.75 143.64 32.31 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.9 pt -133.63 155.65 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-O 121.48 0.657 . . . . 0.0 109.77 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt85 -150.23 150.73 31.97 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.502 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -72.53 121.62 19.97 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.502 ' N ' HD13 ' A' ' 80' ' ' LEU . 7.7 tpt180 . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.451 -0.78 . . . . 0.0 110.268 -178.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.534 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 1' ' ' MET . 37.9 Cg_endo -62.61 144.37 94.15 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.247 1.965 . . . . 0.0 111.715 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.52 ' O ' ' N ' ' A' ' 5' ' ' GLU . 80.8 m80 -101.68 133.41 46.44 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.605 -0.684 . . . . 0.0 109.24 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.519 ' O ' ' N ' ' A' ' 6' ' ' LYS . 64.4 mttp 54.23 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.885 -0.51 . . . . 0.0 110.218 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 3' ' ' HIS . 39.1 tp10 60.9 -72.44 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.686 -0.634 . . . . 0.0 109.71 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 4' ' ' LYS . 65.2 mttp 54.12 108.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.734 0.778 . . . . 0.0 110.709 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.54 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -66.9 -42.42 42.74 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.28 -0.887 . . . . 0.0 109.986 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 37.9 Cg_exo -60.69 126.68 20.41 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.05 1.834 . . . . 0.0 111.826 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.6 mp -65.32 -42.26 93.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.197 -0.94 . . . . 0.0 109.366 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -55.18 -53.05 60.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.285 -0.884 . . . . 0.0 110.151 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -67.06 -39.44 86.88 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.117 -0.989 . . . . 0.0 109.704 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 49.1 ttp -61.09 -50.09 74.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.249 -0.907 . . . . 0.0 110.045 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -67.47 -38.32 84.22 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.974 -1.079 . . . . 0.0 109.316 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.15 -46.52 89.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.052 -1.03 . . . . 0.0 109.788 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.4 m -62.38 -43.13 99.55 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.258 -0.901 . . . . 0.0 110.399 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.76 -43.1 84.97 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.022 -1.049 . . . . 0.0 110.613 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.95 -44.83 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 109.609 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -67.26 -34.07 76.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.36 -0.837 . . . . 0.0 109.763 -179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.57 94.27 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.354 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.88 7.19 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.317 -0.864 . . . . 0.0 110.183 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.03 -7.11 15.33 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.928 -1.107 . . . . 0.0 109.695 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.717 ' HG2' HH11 ' A' ' 22' ' ' ARG . 12.1 mtp85 -71.2 -19.93 62.33 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.31 -0.869 . . . . 0.0 108.883 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -61.34 -50.96 70.83 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.206 -0.934 . . . . 0.0 109.481 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 26' ' ' TRP . 2.5 m -179.78 77.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.544 -0.722 . . . . 0.0 109.263 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.0 -91.14 0.02 OUTLIER Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.43 ' N ' ' O ' ' A' ' 24' ' ' SER . 70.2 m95 -54.7 -174.07 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.444 -1.033 . . . . 0.0 109.985 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.04 134.29 29.57 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.661 -0.649 . . . . 0.0 109.343 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.36 134.63 48.08 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.342 -0.849 . . . . 0.0 109.335 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.56 -40.58 75.41 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 109.405 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 t -59.34 -43.14 92.8 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.108 -0.995 . . . . 0.0 109.161 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.22 88.07 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.252 -0.905 . . . . 0.0 109.617 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.4 t -63.45 -46.95 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.242 -0.911 . . . . 0.0 109.363 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.15 81.74 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.9 m -62.45 -42.57 99.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.162 -1.199 . . . . 0.0 109.688 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.546 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 67.8 t80 -60.75 -48.6 81.08 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.857 . . . . 0.0 109.387 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.16 -39.08 93.26 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 108.984 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.37 -48.56 80.21 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.115 -0.99 . . . . 0.0 109.468 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -73.15 -51.2 18.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.106 -0.996 . . . . 0.0 110.411 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.546 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 68.8 m-80 -65.43 -39.97 92.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.265 -0.897 . . . . 0.0 109.808 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -123.86 84.66 54.21 Favored Pre-proline 0 N--CA 1.502 2.138 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.32 -28.46 62.76 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.997 1.798 . . . . 0.0 111.333 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.1 p -67.54 -11.83 58.93 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.492 -0.755 . . . . 0.0 109.618 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -75.73 122.63 24.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.12 -0.987 . . . . 0.0 109.122 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -119.58 90.12 42.31 Favored Pre-proline 0 N--CA 1.505 2.278 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -63.28 -20.35 70.34 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.811 1.674 . . . . 0.0 110.776 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -62.71 -38.89 92.25 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.31 -37.97 85.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.296 -0.878 . . . . 0.0 108.725 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.526 ' CD2' ' SD ' ' A' ' 56' ' ' MET . 97.4 m95 -83.95 9.78 11.44 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.241 -0.912 . . . . 0.0 109.336 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 69.17 151.46 0.45 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.41 ' C ' ' H ' ' A' ' 52' ' ' ARG . 86.7 t60 -79.15 147.69 32.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.354 -1.086 . . . . 0.0 109.549 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.13 -40.01 0.7 Allowed Glycine 0 N--CA 1.494 2.513 0 N-CA-C 110.222 -1.151 . . . . 0.0 110.222 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' H ' ' C ' ' A' ' 50' ' ' HIS . 89.4 mtt180 -67.44 -4.89 12.52 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.125 -1.221 . . . . 0.0 108.933 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.66 -40.8 98.2 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -60.53 -42.81 97.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.333 -0.855 . . . . 0.0 109.282 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.406 ' CD ' ' N ' ' A' ' 55' ' ' GLN . 21.8 mp0 -69.15 -27.12 65.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.86 . . . . 0.0 109.565 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.526 ' SD ' ' CD2' ' A' ' 48' ' ' TRP . 46.6 ttp -63.93 -48.73 75.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.932 -1.105 . . . . 0.0 109.481 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.8 m -69.16 -23.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.276 -0.89 . . . . 0.0 109.612 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -62.8 -28.62 70.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.485 -0.759 . . . . 0.0 109.378 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -77.49 -4.13 43.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.96 . . . . 0.0 109.567 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.92 109.82 22.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.352 -0.843 . . . . 0.0 108.984 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.449 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.4 m-20 -64.52 -39.37 93.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.495 -0.753 . . . . 0.0 111.192 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -70.29 19.29 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.851 -1.156 . . . . 0.0 111.288 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.449 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.7 mt -138.15 126.61 23.33 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.26 -0.9 . . . . 0.0 108.857 178.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 43.2 m -88.59 130.97 35.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.6 t -115.6 130.67 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 121.574 -0.704 . . . . 0.0 109.356 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.413 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -142.3 153.72 44.12 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.462 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.3 mp0 -107.46 119.11 38.51 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.4 m -85.49 155.86 21.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.216 -0.927 . . . . 0.0 108.511 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.83 83.17 4.75 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.543 ' ND2' ' CE1' ' A' ' 75' ' ' HIS . 52.6 t-20 -94.0 104.92 16.95 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.417 -0.802 . . . . 0.0 109.502 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.17 -142.09 44.92 Favored Glycine 0 N--CA 1.488 2.104 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.62 -6.39 58.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.405 -1.056 . . . . 0.0 109.745 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -106.07 142.08 36.37 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.528 -0.732 . . . . 0.0 109.685 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 80.2 mt -91.6 123.39 34.97 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.543 ' CE1' ' ND2' ' A' ' 70' ' ' ASN . 48.2 m170 -101.9 135.63 43.12 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.605 -0.684 . . . . 0.0 109.299 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.1 m -79.24 148.48 32.19 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.412 -0.805 . . . . 0.0 109.133 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.6 mp0 -137.34 155.02 49.9 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.6 pt -134.48 153.6 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.734 -0.603 . . . . 0.0 109.386 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -143.58 148.77 36.4 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -85.76 120.46 27.21 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 -179.743 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.492 ' N ' HD13 ' A' ' 80' ' ' LEU . 20.6 mmt85 -53.84 132.75 42.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.442 -0.786 . . . . 0.0 110.314 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -67.66 -39.7 84.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.684 -0.635 . . . . 0.0 109.58 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.41 145.05 56.68 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.465 -0.772 . . . . 0.0 110.122 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.68 -163.03 8.28 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.491 HD12 ' N ' ' A' ' 85' ' ' LEU . 10.1 mp -73.81 141.34 46.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.237 -1.155 . . . . 0.0 109.036 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -159.03 114.06 2.49 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 109.25 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -156.06 20.31 0.37 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.33 -0.856 . . . . 0.0 108.887 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -65.74 -40.52 92.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.464 -0.773 . . . . 0.0 109.625 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 51.92 179.65 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.436 -0.79 . . . . 0.0 110.021 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -66.22 -39.57 89.67 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.339 -0.851 . . . . 0.0 109.549 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -54.26 -79.06 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.219 -0.926 . . . . 0.0 110.079 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.553 -179.745 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.438 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 18.2 mmt . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 1' ' ' MET . 44.4 Cg_endo -63.93 147.1 92.07 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.391 2.061 . . . . 0.0 112.027 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.443 ' CG ' ' N ' ' A' ' 4' ' ' LYS . 9.0 p80 -152.17 -48.62 0.11 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.588 -0.695 . . . . 0.0 109.316 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.443 ' N ' ' CG ' ' A' ' 3' ' ' HIS . 22.6 pttp -81.49 151.51 27.77 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.303 -0.873 . . . . 0.0 109.75 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.41 147.76 39.73 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.257 -0.902 . . . . 0.0 109.23 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -77.37 -5.36 49.38 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.111 -0.993 . . . . 0.0 109.496 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -73.43 153.03 89.99 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 109.207 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -45.83 138.8 11.48 Favored 'Trans proline' 0 N--CA 1.495 1.568 0 C-N-CA 121.701 1.601 . . . . 0.0 112.066 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.95 -41.48 97.58 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.409 -0.807 . . . . 0.0 109.436 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -57.77 -46.02 85.14 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.21 -0.931 . . . . 0.0 109.387 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.1 -39.1 93.32 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.214 -0.929 . . . . 0.0 109.344 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.73 -52.58 62.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 110.011 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.96 -41.6 74.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.936 -1.102 . . . . 0.0 109.697 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -60.5 -44.91 95.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.195 -0.94 . . . . 0.0 109.477 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.2 m -62.33 -42.22 99.2 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.71 79.72 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.095 -1.003 . . . . 0.0 110.423 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -63.05 -44.81 99.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.129 -0.982 . . . . 0.0 109.404 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.14 -32.04 72.88 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.391 -0.818 . . . . 0.0 109.721 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.89 94.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.0 110.72 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 m -124.12 28.76 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.687 0 O-C-N 121.43 -0.794 . . . . 0.0 110.55 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.91 -34.13 62.81 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.844 -1.16 . . . . 0.0 110.086 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 23' ' ' ASP . 35.8 mtm-85 44.95 77.14 0.08 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.241 -0.912 . . . . 0.0 109.741 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 22' ' ' ARG . 83.9 m-20 57.69 150.39 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.946 0.879 . . . . 0.0 111.014 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.8 m 57.98 157.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.503 -0.748 . . . . 0.0 110.229 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.73 0.22 86.6 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.12 144.69 27.38 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.313 -1.11 . . . . 0.0 109.587 -179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.75 139.12 29.27 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.457 -0.777 . . . . 0.0 108.93 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.07 131.22 45.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.165 -0.959 . . . . 0.0 109.745 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.13 -37.5 74.74 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.509 -0.744 . . . . 0.0 109.589 -178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -57.19 -44.01 83.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.149 -0.969 . . . . 0.0 109.203 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.9 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.211 -0.931 . . . . 0.0 109.271 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.69 -48.32 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.285 -0.884 . . . . 0.0 109.355 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.38 86.56 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 26.0 m -62.94 -42.29 99.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.163 -1.198 . . . . 0.0 109.529 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.551 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 76.8 t80 -60.7 -47.09 87.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.352 -0.843 . . . . 0.0 109.476 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.4 mt -62.51 -42.09 99.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.279 -0.888 . . . . 0.0 109.086 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.66 -42.61 79.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.061 -1.025 . . . . 0.0 109.495 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -64.31 -42.19 96.46 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.15 -0.969 . . . . 0.0 109.561 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.551 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 81.0 m-20 -90.09 5.14 48.04 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.193 -0.942 . . . . 0.0 109.287 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 36' ' ' LEU . 49.2 t0 -162.7 73.13 2.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.34 -15.82 49.4 Favored 'Trans proline' 0 N--CA 1.489 1.262 0 C-N-CA 121.226 1.284 . . . . 0.0 111.006 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 69.1 m -74.49 -7.87 54.45 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -74.75 136.36 41.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.475 -0.765 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -119.12 92.67 45.78 Favored Pre-proline 0 N--CA 1.506 2.33 0 O-C-N 121.949 -0.469 . . . . 0.0 110.151 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -64.01 -16.31 54.16 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 122.061 1.841 . . . . 0.0 111.882 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.58 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 5.3 mpt_? -64.49 -39.88 94.62 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -63.48 -37.49 87.5 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -92.85 22.62 4.71 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.282 -0.886 . . . . 0.0 108.742 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 70.31 160.53 3.15 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 31.7 p80 -77.99 -18.5 55.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.345 -1.091 . . . . 0.0 109.57 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.43 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -135.83 -19.25 0.73 Allowed Glycine 0 N--CA 1.505 3.244 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -67.88 2.89 1.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.11 -1.229 . . . . 0.0 109.122 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 51' ' ' GLY . 64.4 tp -62.43 -38.35 89.39 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -58.95 -42.56 90.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.17 -0.956 . . . . 0.0 109.145 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -66.17 -30.37 70.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.534 -0.729 . . . . 0.0 109.775 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.7 75.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.856 -1.152 . . . . 0.0 110.046 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 57' ' ' VAL . 17.1 m -71.12 -17.96 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.246 -0.909 . . . . 0.0 109.801 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.67 -29.21 69.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.359 -0.838 . . . . 0.0 109.369 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -63.03 -32.22 73.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.324 -0.86 . . . . 0.0 109.433 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 63.3 mt -71.93 112.8 8.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.244 -0.91 . . . . 0.0 109.228 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 63' ' ' LEU . 97.3 m-20 -64.4 -40.89 96.68 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.5 -0.75 . . . . 0.0 111.387 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 53.0 p90 -69.78 20.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.727 -1.233 . . . . 0.0 111.347 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.8 mt -137.82 133.48 34.02 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.274 -0.891 . . . . 0.0 109.222 179.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.474 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 89.2 m -97.58 135.28 39.63 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -118.11 132.92 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -134.87 117.86 16.33 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -97.65 119.35 36.06 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.548 -0.72 . . . . 0.0 109.191 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.6 m -102.67 122.29 44.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.571 -0.706 . . . . 0.0 109.357 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 133.49 43.77 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.987 -1.07 . . . . 0.0 109.227 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.1 t-20 -149.89 95.68 2.34 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.561 -0.712 . . . . 0.0 109.482 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 62.99 -139.47 44.78 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.6 t -83.85 -7.33 59.47 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.403 -1.057 . . . . 0.0 110.387 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -125.59 123.4 38.96 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.504 -0.748 . . . . 0.0 109.293 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -87.06 153.97 21.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.103 -0.998 . . . . 0.0 108.775 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -105.23 99.79 9.4 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.546 -0.721 . . . . 0.0 109.102 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.1 t -74.56 145.85 43.08 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.608 -0.683 . . . . 0.0 109.343 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -139.91 155.69 47.05 Favored 'General case' 0 N--CA 1.502 2.132 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.1 pt -133.33 151.05 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 CA-C-O 121.252 0.549 . . . . 0.0 109.592 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -151.94 141.48 21.69 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 19.8 mt -74.38 139.01 43.78 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.283 -0.885 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.474 ' NE ' ' OG1' ' A' ' 64' ' ' THR . 22.4 mmt180 -64.51 -42.15 95.97 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.234 -0.916 . . . . 0.0 109.465 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -90.19 120.61 31.5 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.218 -0.926 . . . . 0.0 109.243 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -169.59 -26.65 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.236 -0.915 . . . . 0.0 109.319 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.53 -153.77 21.73 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.1 mt 51.48 86.72 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.232 -1.158 . . . . 0.0 109.755 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -168.74 -73.02 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.359 -0.838 . . . . 0.0 109.047 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -79.03 132.03 36.49 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.256 -0.903 . . . . 0.0 109.541 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.462 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 31.1 p-80 -155.05 163.66 39.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 85.9 t60 52.58 12.1 0.23 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.342 -0.849 . . . . 0.0 109.91 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.462 ' ND1' ' O ' ' A' ' 88' ' ' HIS . 65.8 m80 -93.44 74.55 4.48 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.237 -0.914 . . . . 0.0 109.178 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -66.9 -39.46 87.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.8 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 76.2 t60 . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.784 -179.579 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mmm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.56 146.26 97.09 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 122.484 2.123 . . . . 0.0 112.466 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.73 125.8 1.22 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.398 -0.814 . . . . 0.0 109.094 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.76 114.9 20.72 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.106 -0.996 . . . . 0.0 109.537 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -69.29 -37.81 78.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.372 -0.83 . . . . 0.0 109.251 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -158.77 -48.59 0.06 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.251 -0.905 . . . . 0.0 108.804 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 57.68 172.3 0.05 OUTLIER Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 121.373 -0.829 . . . . 0.0 109.44 179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.41 143.22 97.95 Favored 'Trans proline' 0 N--CA 1.502 2.022 0 C-N-CA 121.965 1.776 . . . . 0.0 111.921 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.523 HD12 ' N ' ' A' ' 9' ' ' LEU . 10.0 mp -63.35 -43.94 96.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.144 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -63.76 -47.63 80.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.812 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -63.77 -35.76 81.65 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.933 . . . . 0.0 109.363 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 24.7 ttt -64.15 -61.0 2.53 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.396 -0.815 . . . . 0.0 110.032 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -65.21 -39.95 93.47 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.15 -0.969 . . . . 0.0 109.974 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.1 m -61.12 -45.3 95.26 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.001 -1.062 . . . . 0.0 109.882 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -61.56 -43.56 98.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.023 -1.048 . . . . 0.0 109.981 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.55 -48.15 35.24 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.292 -0.88 . . . . 0.0 110.706 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.443 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.0 mt -63.11 -44.63 99.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.287 -0.883 . . . . 0.0 109.542 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -66.5 -35.16 79.57 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.304 -0.872 . . . . 0.0 109.936 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.5 -38.65 91.97 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.119 -0.988 . . . . 0.0 110.02 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 m -110.41 11.54 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.361 0 O-C-N 121.608 -0.683 . . . . 0.0 109.789 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -59.82 -23.49 63.39 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.879 -1.138 . . . . 0.0 108.713 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 51.77 29.04 5.41 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.6 -0.688 . . . . 0.0 109.85 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 55.4 8.42 0.29 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.374 -0.829 . . . . 0.0 110.5 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.6 p -87.7 -3.52 58.96 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.812 -1.18 . . . . 0.0 108.804 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.66 -59.03 5.0 Favored Glycine 0 N--CA 1.496 2.679 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.461 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 99.1 m95 -75.4 177.22 6.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.407 -1.055 . . . . 0.0 109.442 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 137.3 9.46 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.264 -0.898 . . . . 0.0 108.874 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -69.39 125.71 27.54 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.286 -0.884 . . . . 0.0 109.424 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 61.4 tp -57.73 -40.0 78.59 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.675 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -57.42 -42.27 82.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.064 -1.022 . . . . 0.0 109.132 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.17 89.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.221 -0.924 . . . . 0.0 109.528 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.63 -48.39 88.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 109.493 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.04 -42.7 99.88 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.1 p -66.25 -40.79 90.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.178 -1.19 . . . . 0.0 109.967 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -61.61 -44.69 96.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.245 -0.909 . . . . 0.0 109.476 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.1 mt -61.41 -41.83 97.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.123 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.49 -39.55 84.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.346 -0.846 . . . . 0.0 109.094 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -61.6 -46.09 91.34 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.277 -0.889 . . . . 0.0 109.481 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -88.57 -4.51 58.57 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.145 -0.972 . . . . 0.0 109.167 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 36' ' ' LEU . 4.4 m-20 -153.56 64.28 4.87 Favored Pre-proline 0 N--CA 1.494 1.749 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.0 -18.5 63.93 Favored 'Trans proline' 0 N--CA 1.494 1.506 0 C-N-CA 121.5 1.467 . . . . 0.0 111.034 -179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.0 m -76.14 -7.01 53.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 108.578 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -75.95 164.62 25.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.533 -0.73 . . . . 0.0 109.3 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -131.13 79.61 70.55 Favored Pre-proline 0 N--CA 1.504 2.261 0 O-C-N 121.611 -0.681 . . . . 0.0 110.116 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -55.17 -36.33 92.94 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.95 1.767 . . . . 0.0 111.142 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.58 -34.32 77.55 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.298 0.57 . . . . 0.0 110.158 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 49' ' ' GLY . 44.6 t30 -60.0 -36.59 77.54 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 108.99 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -78.36 24.56 0.26 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.243 -0.911 . . . . 0.0 109.265 179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 74.51 161.8 8.48 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.513 ' C ' ' H ' ' A' ' 52' ' ' ARG . 99.5 m-70 -90.7 123.84 34.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.273 -1.134 . . . . 0.0 109.558 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 69.59 -21.63 0.43 Allowed Glycine 0 N--CA 1.494 2.508 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 50' ' ' HIS . 76.2 mtp85 -71.39 -1.88 14.57 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.185 -1.185 . . . . 0.0 109.007 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.9 tp -61.77 -37.71 85.33 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 t -58.89 -41.97 88.44 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.361 -0.837 . . . . 0.0 109.319 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -65.65 -31.65 72.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.191 -0.943 . . . . 0.0 109.862 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.7 tpt -64.78 -48.6 73.91 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.87 -1.144 . . . . 0.0 109.962 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.0 m -75.14 -16.27 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 O-C-N 121.116 -0.99 . . . . 0.0 109.678 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -60.92 -28.13 68.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.424 -0.797 . . . . 0.0 109.688 -179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -70.37 -3.3 16.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.133 -0.979 . . . . 0.0 109.006 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.0 mt -99.92 124.59 45.41 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.499 -0.75 . . . . 0.0 109.058 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.7 p-10 -73.44 -36.63 65.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.441 -0.787 . . . . 0.0 111.622 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.461 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 51.6 p90 -73.5 18.81 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.684 -1.26 . . . . 0.0 110.907 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.6 mt -136.33 125.03 23.81 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.318 -0.864 . . . . 0.0 109.165 179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.8 m -89.31 141.95 28.09 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.367 -0.833 . . . . 0.0 109.09 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.5 t -116.06 130.35 70.93 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.618 0.723 . . . . 0.0 109.396 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.461 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 51.1 tt0 -153.78 150.63 28.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -140.48 127.91 21.32 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.384 -0.823 . . . . 0.0 109.079 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.7 p -81.71 154.45 26.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.889 -1.132 . . . . 0.0 108.724 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.606 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -90.34 132.45 35.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.215 -0.928 . . . . 0.0 108.711 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -150.66 98.82 2.67 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.886 -1.134 . . . . 0.0 109.643 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 55.51 -140.89 39.54 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 62.1 m -86.32 -7.84 58.17 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.26 -1.141 . . . . 0.0 109.655 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -103.14 118.21 36.28 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.339 -0.851 . . . . 0.0 109.491 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.11 134.82 33.47 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -100.87 104.31 15.53 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 m -74.2 148.84 41.26 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.435 -0.791 . . . . 0.0 109.174 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -141.5 152.04 43.83 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.426 -0.796 . . . . 0.0 108.945 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.3 pt -139.97 152.12 22.1 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.659 -0.65 . . . . 0.0 109.437 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -157.04 154.76 30.05 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.93 138.18 58.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.116 -0.99 . . . . 0.0 109.757 -179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.8 ttp85 -70.65 81.38 0.6 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 109.799 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -161.21 157.53 25.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.423 -0.798 . . . . 0.0 109.267 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 53.12 34.08 16.51 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.428 -0.795 . . . . 0.0 109.67 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -157.26 91.26 0.12 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.492 HD22 ' N ' ' A' ' 85' ' ' LEU . 3.8 mm? -88.11 -1.03 57.76 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.211 -1.17 . . . . 0.0 109.016 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 85' ' ' LEU . 24.8 mp0 53.63 105.93 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.002 0 CA-C-O 121.55 0.691 . . . . 0.0 110.23 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -70.81 149.46 46.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.205 -0.934 . . . . 0.0 109.448 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 79.6 m80 52.24 178.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.465 -0.772 . . . . 0.0 109.996 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -85.53 144.07 28.14 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.159 -0.963 . . . . 0.0 109.832 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -71.95 142.72 49.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.409 -0.807 . . . . 0.0 109.581 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -72.68 141.27 48.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.249 -0.907 . . . . 0.0 109.836 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.106 179.818 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.487 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.0 mpt? . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 26.6 Cg_exo -61.39 144.9 98.55 Favored 'Trans proline' 0 N--CA 1.5 1.897 0 C-N-CA 122.468 2.112 . . . . 0.0 111.953 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' O ' ' N ' ' A' ' 5' ' ' GLU . 88.2 m-70 -159.07 -61.07 0.07 Allowed 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.341 -0.85 . . . . 0.0 109.342 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt 59.16 -73.1 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.163 0 CA-C-O 121.123 0.487 . . . . 0.0 110.225 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.518 ' N ' ' O ' ' A' ' 3' ' ' HIS . 82.4 tt0 -62.5 -91.5 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.034 -1.042 . . . . 0.0 109.914 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 pttt -97.67 126.06 42.79 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.274 -0.891 . . . . 0.0 110.66 -179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.574 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.06 -34.16 0.39 Allowed Pre-proline 0 N--CA 1.5 2.047 0 O-C-N 121.562 -0.711 . . . . 0.0 110.203 179.665 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 44.6 Cg_exo -58.41 127.9 26.44 Favored 'Trans proline' 0 N--CA 1.498 1.787 0 C-N-CA 121.095 1.197 . . . . 0.0 112.055 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 54.9 mt -68.53 -40.27 80.81 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.464 -0.773 . . . . 0.0 109.091 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -56.82 -45.63 82.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -0.94 . . . . 0.0 109.307 -179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -65.0 -36.97 86.13 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.355 -0.841 . . . . 0.0 109.217 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 42.4 ttp -62.66 -53.74 49.93 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.418 -0.801 . . . . 0.0 110.0 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -70.7 -41.5 71.89 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.917 -1.115 . . . . 0.0 110.123 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.2 m -60.58 -45.89 92.25 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.883 -1.135 . . . . 0.0 110.119 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -61.41 -45.15 95.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.47 77.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.204 -0.935 . . . . 0.0 111.106 -178.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.1 mt -61.87 -46.96 95.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.114 -0.991 . . . . 0.0 109.451 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.88 -29.23 69.07 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.433 -0.792 . . . . 0.0 109.8 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.22 -42.89 96.39 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.149 -0.97 . . . . 0.0 110.708 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ARG . 12.6 m -111.98 20.45 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.545 0 O-C-N 121.512 -0.742 . . . . 0.0 109.989 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 2.82 1.31 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.825 -1.172 . . . . 0.0 109.321 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.0 mmt180 61.19 -146.34 0.44 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.302 -0.874 . . . . 0.0 109.386 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -59.9 -49.99 75.54 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.626 -0.671 . . . . 0.0 110.178 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 t 176.76 87.72 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.284 -0.885 . . . . 0.0 108.804 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -174.59 -171.2 38.59 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.468 -1.348 . . . . 0.0 109.888 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -58.77 -174.35 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.67 -0.9 . . . . 0.0 109.556 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.69 142.36 30.01 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.462 -0.774 . . . . 0.0 109.166 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -67.93 132.85 48.09 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.161 -0.962 . . . . 0.0 110.085 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.27 -39.79 80.14 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.206 -0.934 . . . . 0.0 109.275 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.5 p -55.8 -42.4 75.54 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 109.241 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.39 87.17 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.582 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.29 -48.29 89.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.096 -1.003 . . . . 0.0 109.901 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.61 -46.74 93.49 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -64.76 -42.89 94.78 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.109 -1.23 . . . . 0.0 110.094 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.536 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 68.3 t80 -61.21 -48.4 81.67 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.232 -0.917 . . . . 0.0 109.736 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 40' ' ' ASP . 90.1 mt -63.12 -41.97 99.44 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.396 -0.815 . . . . 0.0 109.11 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.33 93.92 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 108.936 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -64.14 -44.77 91.15 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.295 -0.878 . . . . 0.0 109.707 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.536 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.8 m-80 -82.99 -8.24 59.58 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.188 -0.945 . . . . 0.0 109.494 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.48 ' N ' ' O ' ' A' ' 36' ' ' LEU . 5.1 m-20 -153.76 77.22 5.83 Favored Pre-proline 0 N--CA 1.495 1.812 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.37 -30.29 62.46 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.804 1.669 . . . . 0.0 111.115 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 83.6 p -69.01 -12.47 61.72 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.617 -0.677 . . . . 0.0 109.678 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -76.84 122.85 25.38 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.975 . . . . 0.0 108.399 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -115.41 96.77 46.82 Favored Pre-proline 0 N--CA 1.506 2.368 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.7 -7.42 20.12 Favored 'Trans proline' 0 N--CA 1.493 1.479 0 CA-C-N 120.187 1.103 . . . . 0.0 111.254 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -62.79 -41.45 99.28 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -62.76 -37.48 86.77 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.439 -0.788 . . . . 0.0 109.151 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -81.51 26.4 0.47 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.274 -0.891 . . . . 0.0 109.359 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 56.75 98.91 0.01 OUTLIER Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -48.93 -28.66 3.99 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -1.187 . . . . 0.0 110.62 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.47 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . -96.18 -55.54 1.27 Allowed Glycine 0 N--CA 1.502 3.072 0 N-CA-C 108.771 -1.731 . . . . 0.0 108.771 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -62.94 2.75 0.28 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.39 -1.065 . . . . 0.0 109.607 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 51' ' ' GLY . 57.4 tp -60.44 -42.23 95.69 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.2 t -62.91 -25.93 68.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.489 -0.757 . . . . 0.0 109.739 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -85.09 -34.97 22.1 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 120.976 -1.077 . . . . 0.0 110.056 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.69 -43.58 88.81 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.887 -1.133 . . . . 0.0 109.872 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 m -63.33 -20.65 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.082 -1.011 . . . . 0.0 109.647 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -69.45 -19.78 63.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.357 -0.839 . . . . 0.0 109.537 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -86.6 0.4 54.51 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.204 -0.935 . . . . 0.0 109.616 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' PHE . 90.5 mt -85.44 -5.48 59.29 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.922 -1.111 . . . . 0.0 109.015 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 63' ' ' LEU . 8.6 m-20 57.85 -65.29 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.526 -0.734 . . . . 0.0 111.958 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 60' ' ' LEU . 52.6 p90 -63.21 19.07 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.63 -1.294 . . . . 0.0 111.999 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 61' ' ' ASP . 8.1 mt -136.21 128.91 30.8 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.061 -1.024 . . . . 0.0 108.875 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 60.8 m -89.26 140.74 29.18 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 66.8 t -119.18 131.52 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 O-C-N 121.482 -0.761 . . . . 0.0 109.239 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -141.56 151.85 43.56 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.92 120.03 41.13 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 m -91.57 151.03 20.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.243 -0.911 . . . . 0.0 108.57 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 69' ' ' ARG . 15.0 mtm180 -91.85 114.27 26.76 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -149.99 118.01 6.32 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.267 -0.896 . . . . 0.0 110.161 -178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.68 -171.11 2.55 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 65.2 m -78.41 28.94 0.19 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.412 -1.052 . . . . 0.0 109.61 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -144.78 119.56 9.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.301 -0.874 . . . . 0.0 109.076 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 mt -68.12 132.68 47.64 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 m170 -101.31 119.13 38.29 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.557 -0.714 . . . . 0.0 109.229 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.3 t -71.41 149.74 45.67 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 109.397 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -141.2 148.76 40.47 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 pt -133.64 147.32 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.176 0 O-C-N 121.558 -0.714 . . . . 0.0 109.563 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -157.98 154.02 27.08 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.29 136.85 57.08 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -66.54 -24.95 66.45 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.45 -0.781 . . . . 0.0 109.94 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -65.33 -42.89 92.47 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.219 -0.926 . . . . 0.0 109.697 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -90.19 112.28 23.73 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.265 -0.897 . . . . 0.0 109.627 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.403 ' O ' ' O ' ' A' ' 85' ' ' LEU . . . 158.76 0.53 0.08 OUTLIER Glycine 0 N--CA 1.496 2.684 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.403 ' O ' ' O ' ' A' ' 84' ' ' GLY . 45.2 mt 53.69 100.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.556 -0.967 . . . . 0.0 109.159 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -60.57 138.88 57.99 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.842 . . . . 0.0 110.169 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -167.15 117.52 0.87 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.391 -0.818 . . . . 0.0 108.932 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -77.55 130.21 36.65 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.02 -1.05 . . . . 0.0 109.308 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -70.99 134.85 47.49 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.156 -0.965 . . . . 0.0 109.609 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' A' ' 90' ' ' HIS . 58.3 t-80 -77.78 50.89 0.88 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.2 -0.937 . . . . 0.0 109.598 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.3 m170 51.3 -175.53 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.476 -0.765 . . . . 0.0 110.47 179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 40.9 p-80 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.098 -0.953 . . . . 0.0 109.382 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.554 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 3.8 ttm . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.554 ' CD ' ' N ' ' A' ' 1' ' ' MET . 24.6 Cg_exo -64.57 6.28 0.35 Allowed 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 122.24 1.96 . . . . 0.0 111.704 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.467 ' C ' ' H ' ' A' ' 5' ' ' GLU . 97.9 m-70 -67.44 -35.61 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.208 -0.933 . . . . 0.0 109.71 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -70.92 37.99 0.05 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.183 -0.948 . . . . 0.0 110.046 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.467 ' H ' ' C ' ' A' ' 3' ' ' HIS . 79.4 tt0 -77.56 -79.1 0.12 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.024 -1.048 . . . . 0.0 108.509 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt 50.58 -110.81 0.48 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.341 -0.849 . . . . 0.0 110.267 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -74.37 153.28 87.99 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.077 -1.014 . . . . 0.0 109.14 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -47.84 135.04 23.02 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.353 1.369 . . . . 0.0 111.969 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.9 -42.69 97.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.171 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -59.97 -47.82 84.22 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.251 -0.906 . . . . 0.0 109.437 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.3 -35.44 80.38 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.372 -0.83 . . . . 0.0 109.724 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.3 ttt -62.58 -50.83 69.73 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.279 -0.888 . . . . 0.0 110.35 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -69.16 -48.68 61.61 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.859 -1.151 . . . . 0.0 110.312 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.4 p -60.65 -43.84 97.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.975 -1.078 . . . . 0.0 110.257 -178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m -60.64 -44.32 96.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.11 -0.994 . . . . 0.0 110.176 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.54 -41.96 75.24 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 110.505 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 21' ' ' ALA . 93.6 mt -63.64 -46.18 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.161 -0.962 . . . . 0.0 109.93 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.66 -33.96 77.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.025 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.64 91.71 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.166 -0.959 . . . . 0.0 109.913 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.1 m -101.74 -2.78 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.235 0 O-C-N 121.364 -0.835 . . . . 0.0 109.968 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.506 ' C ' ' H ' ' A' ' 23' ' ' ASP . . . -62.12 -23.45 66.55 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.966 -1.084 . . . . 0.0 108.896 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.4 ttm180 61.74 -2.97 0.24 Allowed 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.402 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.506 ' H ' ' C ' ' A' ' 21' ' ' ALA . 8.8 p30 -175.11 -101.41 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.799 -1.188 . . . . 0.0 108.827 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.48 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 29.9 t -162.02 91.96 0.82 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.925 -1.109 . . . . 0.0 108.89 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.09 -149.35 8.23 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.418 ' CH2' ' CD ' ' A' ' 66' ' ' GLN . 99.2 m95 -68.04 -178.44 1.01 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.632 -0.922 . . . . 0.0 110.044 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -159.57 149.92 19.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.372 -0.83 . . . . 0.0 108.912 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 40.6 mp0 -76.98 128.42 34.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.244 -0.91 . . . . 0.0 109.581 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.85 -39.85 78.69 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -55.63 -43.0 75.75 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.067 -1.021 . . . . 0.0 109.612 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.55 -38.22 90.25 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.131 -0.98 . . . . 0.0 109.546 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.3 t -62.7 -48.22 89.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.163 -0.961 . . . . 0.0 109.544 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.85 -48.65 85.19 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 -179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -63.2 -42.63 99.35 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.179 -1.189 . . . . 0.0 109.505 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.557 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 83.7 t80 -60.12 -45.51 92.75 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.338 -0.851 . . . . 0.0 109.505 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 40' ' ' ASP . 66.5 mt -61.67 -43.06 99.57 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.963 . . . . 0.0 109.187 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.46 91.0 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.16 -0.962 . . . . 0.0 109.132 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.9 -44.69 95.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.885 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.557 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.2 m-80 -89.61 2.04 55.21 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.247 -0.908 . . . . 0.0 109.226 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.457 ' N ' ' O ' ' A' ' 36' ' ' LEU . 50.0 t0 -162.81 73.8 2.06 Favored Pre-proline 0 N--CA 1.493 1.696 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.03 -14.96 45.51 Favored 'Trans proline' 0 N--CA 1.492 1.435 0 C-N-CA 121.405 1.403 . . . . 0.0 111.306 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 88.2 p -74.95 -8.96 58.01 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -72.94 141.09 47.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.428 -0.795 . . . . 0.0 109.385 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -119.72 92.56 46.53 Favored Pre-proline 0 N--CA 1.502 2.158 0 O-C-N 121.67 -0.644 . . . . 0.0 109.919 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -58.09 -19.29 40.38 Favored 'Trans proline' 0 N--CA 1.497 1.729 0 C-N-CA 122.009 1.806 . . . . 0.0 111.525 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -63.72 -36.53 84.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.505 -0.747 . . . . 0.0 109.199 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -63.02 -36.24 82.91 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.114 -0.991 . . . . 0.0 108.471 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 38.1 m95 -78.57 7.21 7.11 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.829 . . . . 0.0 109.394 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 62.92 152.23 0.04 OUTLIER Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.449 ' C ' ' H ' ' A' ' 52' ' ' ARG . 59.3 t-80 -78.41 132.15 37.22 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.45 -1.029 . . . . 0.0 109.603 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 73.57 -32.61 0.85 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.449 ' H ' ' C ' ' A' ' 50' ' ' HIS . 64.5 ttt180 -67.12 -12.01 58.8 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.272 -1.134 . . . . 0.0 108.49 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.7 tp -61.34 -42.96 99.54 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 108.587 179.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.3 t -62.47 -42.82 99.75 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.471 -0.768 . . . . 0.0 109.423 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -69.14 -32.23 71.44 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.176 -0.953 . . . . 0.0 109.918 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -46.31 88.99 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.095 -1.003 . . . . 0.0 109.783 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.1 -24.74 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.171 -0.955 . . . . 0.0 109.246 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.95 -29.27 69.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.504 -0.747 . . . . 0.0 109.725 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -70.87 -3.04 17.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.951 . . . . 0.0 109.783 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 64.2 mt -102.38 125.01 48.96 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 35.4 p-10 -68.19 -38.7 82.3 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.341 -0.85 . . . . 0.0 111.536 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.419 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 45.2 p90 -76.45 16.0 0.54 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.715 -1.24 . . . . 0.0 110.433 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.408 HD13 ' N ' ' A' ' 64' ' ' THR . 0.7 OUTLIER -133.53 117.04 16.66 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.324 -0.86 . . . . 0.0 109.053 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.408 ' N ' HD13 ' A' ' 63' ' ' LEU . 62.7 m -90.4 141.81 28.36 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.213 -0.929 . . . . 0.0 109.711 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.5 t -126.7 133.79 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.67 -0.644 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' CD ' ' CH2' ' A' ' 26' ' ' TRP . 86.6 mt-30 -141.05 137.04 32.62 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -102.37 121.18 41.8 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.52 -0.737 . . . . 0.0 109.122 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.8 m -92.45 141.74 28.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.279 -0.888 . . . . 0.0 108.998 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.593 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -88.11 90.42 8.38 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.269 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -99.61 106.3 18.25 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.064 -1.023 . . . . 0.0 109.676 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.33 -138.76 47.48 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.3 p -86.94 -8.4 57.26 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.273 -1.133 . . . . 0.0 109.802 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -113.0 122.77 48.61 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.441 -0.787 . . . . 0.0 109.805 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mp -85.01 131.51 34.46 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -107.7 125.61 51.59 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-O 121.521 0.677 . . . . 0.0 109.41 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 t -70.8 154.64 41.66 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.547 -0.72 . . . . 0.0 109.635 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -137.84 154.86 49.46 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.9 pt -136.99 151.42 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 CA-C-O 121.444 0.64 . . . . 0.0 109.673 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 67.1 ttp85 -151.19 144.9 25.04 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.4 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.3 OUTLIER -90.49 113.41 25.37 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.301 -0.874 . . . . 0.0 109.236 -178.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.4 ' N ' HD13 ' A' ' 80' ' ' LEU . 61.6 ttm-85 -75.89 89.73 2.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.482 -0.761 . . . . 0.0 109.938 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.427 ' H ' ' H ' ' A' ' 83' ' ' ASP . 55.6 t-80 -170.93 -5.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.427 ' H ' ' H ' ' A' ' 82' ' ' HIS . 35.8 p30 -80.42 -3.09 48.44 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.391 -0.818 . . . . 0.0 109.72 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -76.09 93.1 0.96 Allowed Glycine 0 N--CA 1.495 2.606 0 N-CA-C 109.008 -1.637 . . . . 0.0 109.008 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 63.5 mt -83.28 137.8 33.84 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.173 -1.192 . . . . 0.0 109.674 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 49.19 -166.26 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.407 -0.808 . . . . 0.0 110.324 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -136.57 132.29 34.96 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.583 -0.698 . . . . 0.0 109.219 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -154.15 165.83 35.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.404 -0.81 . . . . 0.0 109.309 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 52.2 m170 51.98 78.99 0.11 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.476 -0.765 . . . . 0.0 109.871 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -153.44 10.65 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.488 -0.757 . . . . 0.0 109.054 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -66.08 -42.14 89.78 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.897 . . . . 0.0 109.858 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 59.6 t-80 . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.474 -179.87 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.0 tpt . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.1 144.97 99.41 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 122.462 2.108 . . . . 0.0 111.999 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -75.02 -78.66 0.1 Allowed 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.172 -0.955 . . . . 0.0 109.382 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.614 ' C ' ' H ' ' A' ' 6' ' ' LYS . 68.7 mttm -64.97 -43.62 92.04 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.506 -0.746 . . . . 0.0 110.17 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 62.25 -19.06 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.795 -0.566 . . . . 0.0 110.018 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.614 ' H ' ' C ' ' A' ' 4' ' ' LYS . 37.2 ttpt -65.82 -43.81 87.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.961 -1.087 . . . . 0.0 110.383 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.418 ' ND1' ' O ' ' A' ' 6' ' ' LYS . 25.0 m-70 -157.18 153.94 24.86 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 121.069 -1.019 . . . . 0.0 109.085 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -45.03 138.02 9.26 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 121.573 1.516 . . . . 0.0 112.386 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.9 mt -63.58 -40.94 98.25 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.491 -0.755 . . . . 0.0 109.167 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.54 -38.39 77.69 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.472 -0.768 . . . . 0.0 108.947 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -61.73 -42.08 98.49 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.315 -0.865 . . . . 0.0 109.351 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.413 ' SD ' HD22 ' A' ' 36' ' ' LEU . 47.9 mmm -63.54 -44.85 93.0 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.137 -0.977 . . . . 0.0 109.326 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -69.5 -44.31 71.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.182 -0.949 . . . . 0.0 110.094 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 26.7 m -62.75 -46.23 89.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.058 -1.026 . . . . 0.0 110.206 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -67.71 -39.1 84.39 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.283 -0.886 . . . . 0.0 110.202 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -75.47 -48.89 20.64 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.048 -1.032 . . . . 0.0 110.897 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.15 -45.0 99.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.047 -1.033 . . . . 0.0 109.347 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.86 -31.76 72.58 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.383 -0.823 . . . . 0.0 109.71 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.52 96.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.986 -1.071 . . . . 0.0 110.303 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.1 m -118.97 23.94 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.477 -0.764 . . . . 0.0 109.613 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.04 -33.49 70.82 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.905 -1.122 . . . . 0.0 109.372 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' O ' ' N ' ' A' ' 24' ' ' SER . 20.5 mtm180 51.8 97.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.819 . . . . 0.0 110.476 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 51.07 -82.7 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.343 -0.848 . . . . 0.0 110.668 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 22' ' ' ARG . 11.6 p -65.14 157.86 27.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.184 -0.948 . . . . 0.0 109.642 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -80.1 1.85 78.34 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.411 ' CH2' ' OE1' ' A' ' 66' ' ' GLN . 96.5 m95 -85.03 148.8 25.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.074 -1.25 . . . . 0.0 109.26 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.41 145.68 31.23 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.359 -0.838 . . . . 0.0 109.027 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -69.14 132.35 46.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.264 -0.897 . . . . 0.0 109.497 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 53' ' ' LEU . 31.2 tp -56.73 -39.94 74.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.46 -0.775 . . . . 0.0 109.275 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.6 m -58.57 -44.04 89.61 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.141 -0.974 . . . . 0.0 109.267 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.38 -36.48 80.37 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 109.593 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.42 -48.24 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.232 -0.917 . . . . 0.0 109.312 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.82 -48.78 78.3 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.2 t -62.17 -45.11 94.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.125 -1.22 . . . . 0.0 109.745 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.466 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 74.7 t80 -60.09 -48.53 81.34 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.326 -0.859 . . . . 0.0 109.295 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.413 HD22 ' SD ' ' A' ' 12' ' ' MET . 98.2 mt -65.93 -39.56 90.61 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.216 -0.928 . . . . 0.0 109.382 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.53 75.98 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.057 -1.027 . . . . 0.0 109.824 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -62.44 -41.08 98.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.075 -1.016 . . . . 0.0 109.526 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.466 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 5.0 m120 -64.36 -40.28 95.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.221 -0.924 . . . . 0.0 109.353 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -85.28 152.58 58.36 Favored Pre-proline 0 N--CA 1.497 1.922 0 O-C-N 121.19 -0.944 . . . . 0.0 108.683 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -45.97 -43.91 19.4 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.439 1.426 . . . . 0.0 111.312 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.9 m -145.65 -92.82 0.09 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.55 ' CZ ' ' NZ ' ' A' ' 4' ' ' LYS . 54.6 t80 61.81 144.71 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 CA-C-O 121.912 0.863 . . . . 0.0 108.99 -179.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -158.76 94.35 1.87 Allowed Pre-proline 0 N--CA 1.496 1.828 0 O-C-N 121.536 -0.727 . . . . 0.0 109.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -70.35 -22.77 28.9 Favored 'Trans proline' 0 C--N 1.315 -1.222 0 CA-C-N 119.536 0.87 . . . . 0.0 110.485 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 48.5 mtm180 -66.05 -51.68 56.0 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.321 -0.862 . . . . 0.0 109.423 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -64.0 -11.23 27.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.238 -0.914 . . . . 0.0 110.341 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.451 ' HE3' ' HE ' ' A' ' 52' ' ' ARG . 2.4 m95 -81.16 3.01 25.09 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.904 -1.123 . . . . 0.0 108.954 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.47 164.2 12.6 Favored Glycine 0 N--CA 1.51 3.623 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -73.24 129.36 37.88 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.314 -1.109 . . . . 0.0 109.83 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . 83.82 -89.87 1.57 Allowed Glycine 0 N--CA 1.495 2.599 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.451 ' HE ' ' HE3' ' A' ' 48' ' ' TRP . 1.2 tmt_? 50.14 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.994 -0.709 . . . . 0.0 110.613 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.561 ' N ' ' O ' ' A' ' 51' ' ' GLY . 41.6 tp -49.37 -35.99 20.32 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.0 t -66.58 -36.53 82.86 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.295 0.569 . . . . 0.0 109.649 178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -86.2 -32.44 21.2 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 120.995 -1.066 . . . . 0.0 110.244 -179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.8 mtp -64.38 -38.95 92.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.009 -1.057 . . . . 0.0 108.825 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.2 -26.78 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 120.757 -1.214 . . . . 0.0 110.069 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.35 -40.43 82.17 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.187 -0.946 . . . . 0.0 110.635 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -75.43 -0.47 20.14 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 120.923 -1.11 . . . . 0.0 110.263 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 33.1 mt -102.65 115.42 30.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.234 -0.917 . . . . 0.0 109.267 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.409 ' C ' ' H ' ' A' ' 63' ' ' LEU . 68.0 t0 -65.87 -42.5 90.3 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.355 -0.841 . . . . 0.0 111.473 -178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -71.87 15.32 0.15 Allowed 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.868 -1.145 . . . . 0.0 110.806 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.412 HD13 ' N ' ' A' ' 64' ' ' THR . 0.6 OUTLIER -129.23 117.87 21.43 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.391 -0.818 . . . . 0.0 108.954 -179.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.412 ' N ' HD13 ' A' ' 63' ' ' LEU . 51.0 m -88.2 144.74 26.27 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.302 -0.874 . . . . 0.0 109.29 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 49.1 t -118.69 130.79 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 CA-C-O 121.531 0.681 . . . . 0.0 109.851 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.411 ' OE1' ' CH2' ' A' ' 26' ' ' TRP . 49.8 tt0 -145.13 152.64 40.37 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.492 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 54.7 mp0 -127.73 118.11 23.18 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 p -79.43 153.73 29.47 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.158 -0.964 . . . . 0.0 108.433 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 69' ' ' ARG . 22.4 mtt180 -96.24 134.6 39.15 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -150.05 101.82 3.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.291 -0.881 . . . . 0.0 109.623 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.12 -140.73 44.49 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.9 p -86.44 -7.88 58.07 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.283 -1.128 . . . . 0.0 109.828 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -118.67 110.45 17.32 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.596 -0.69 . . . . 0.0 109.627 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.51 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -81.03 149.09 29.41 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -107.46 129.56 54.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.513 -0.742 . . . . 0.0 109.364 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.6 p -70.62 151.57 44.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.451 -0.781 . . . . 0.0 109.395 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -144.36 156.27 44.16 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.0 pt -138.29 155.02 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.247 0 O-C-N 121.479 -0.763 . . . . 0.0 109.852 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -154.21 146.99 24.3 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.386 -0.821 . . . . 0.0 108.804 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 69.0 mt -69.05 136.3 52.16 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.218 -0.926 . . . . 0.0 108.634 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 24.8 ttt180 -78.56 133.08 37.37 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.274 -0.891 . . . . 0.0 109.639 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -166.43 -176.05 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.41 -0.806 . . . . 0.0 108.889 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.2 t0 54.23 13.23 0.58 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.98 105.56 3.2 Favored Glycine 0 N--CA 1.498 2.795 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.464 ' O ' ' ND1' ' A' ' 87' ' ' HIS . 34.3 mt -86.25 -4.94 59.27 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.171 -1.194 . . . . 0.0 108.862 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 52.39 -95.54 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.513 -0.742 . . . . 0.0 110.037 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.464 ' ND1' ' O ' ' A' ' 85' ' ' LEU . 57.6 m80 51.01 94.79 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.069 -1.019 . . . . 0.0 109.57 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -65.93 134.64 53.4 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.227 -0.921 . . . . 0.0 109.034 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -64.76 -42.39 95.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.244 -0.91 . . . . 0.0 109.547 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -91.24 105.44 17.79 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.286 -0.884 . . . . 0.0 109.49 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -168.53 -37.48 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 109.315 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 . . . . . 0 N--CA 1.489 1.499 0 CA-C-O 118.041 -0.98 . . . . 0.0 109.433 -179.894 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.55 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 1' ' ' MET . 31.2 Cg_exo -62.0 145.0 96.9 Favored 'Trans proline' 0 N--CA 1.5 1.908 0 C-N-CA 122.269 1.979 . . . . 0.0 112.363 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -66.96 -37.52 84.42 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.186 -0.946 . . . . 0.0 109.649 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -68.36 138.66 55.57 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.315 -0.866 . . . . 0.0 109.067 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -81.38 -129.34 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.284 -0.885 . . . . 0.0 109.063 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.72 -81.22 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.95 -1.094 . . . . 0.0 109.734 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.94 152.09 58.57 Favored Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.192 -0.943 . . . . 0.0 109.413 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.35 134.94 15.83 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.608 1.539 . . . . 0.0 112.099 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.38 -41.32 96.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.379 -0.826 . . . . 0.0 109.455 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.33 -41.76 72.9 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.209 -0.932 . . . . 0.0 109.53 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -65.26 -44.51 87.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.15 -0.969 . . . . 0.0 108.635 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 81.3 mtp -62.55 -49.05 76.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.862 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -68.64 -42.89 77.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.001 -1.062 . . . . 0.0 109.829 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 97.8 m -63.2 -48.05 79.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.942 -1.099 . . . . 0.0 109.993 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.0 p -65.93 -40.32 91.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.09 -1.006 . . . . 0.0 110.223 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.47 -48.66 31.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.094 -1.004 . . . . 0.0 110.74 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 21' ' ' ALA . 97.6 mt -62.88 -45.03 99.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.248 -0.907 . . . . 0.0 109.495 -179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 tp10 -66.37 -32.83 74.46 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.268 -0.895 . . . . 0.0 109.475 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.58 91.61 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.138 -0.977 . . . . 0.0 110.361 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.3 m -117.96 20.15 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.439 0 O-C-N 121.506 -0.746 . . . . 0.0 109.812 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.14 -27.32 66.97 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.056 -1.027 . . . . 0.0 109.662 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 51.21 85.81 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.724 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 25' ' ' GLY . 31.8 t70 52.78 38.8 27.47 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.07 -1.019 . . . . 0.0 110.499 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 26' ' ' TRP . 4.1 p 62.01 1.24 0.64 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.86 . . . . 0.0 109.688 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 23' ' ' ASP . . . -68.46 76.08 0.27 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 109.195 -1.562 . . . . 0.0 109.195 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.68 ' H ' ' NH2' ' A' ' 79' ' ' ARG . 88.7 m95 40.7 -165.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.896 -0.767 . . . . 0.0 111.216 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.74 133.03 10.85 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -71.38 125.98 28.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 109.577 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.6 tp -54.66 -40.29 68.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 109.265 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -58.53 -43.6 89.29 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.173 -0.955 . . . . 0.0 109.092 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.28 93.62 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 109.541 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 74.6 t -61.95 -49.09 85.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.04 -1.037 . . . . 0.0 109.064 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.98 85.71 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.2 t -61.78 -43.37 98.98 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.159 -1.201 . . . . 0.0 109.729 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.417 ' CE2' ' OD1' ' A' ' 39' ' ' ASN . 72.2 t80 -59.52 -46.7 88.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.278 -0.889 . . . . 0.0 109.549 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.1 mt -63.24 -40.4 97.33 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.287 -0.883 . . . . 0.0 109.209 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.09 -47.86 65.02 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.94 -1.1 . . . . 0.0 109.58 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -63.89 -41.41 97.71 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.329 -0.857 . . . . 0.0 109.298 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.417 ' OD1' ' CE2' ' A' ' 35' ' ' TYR . 10.5 m120 -89.02 8.39 29.92 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.047 -1.033 . . . . 0.0 109.253 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.476 ' N ' ' O ' ' A' ' 36' ' ' LEU . 45.0 t0 -153.38 78.44 5.74 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.335 -0.853 . . . . 0.0 109.173 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.415 ' O ' ' CB ' ' A' ' 42' ' ' SER . 21.1 Cg_exo -62.96 156.52 53.89 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 122.35 2.033 . . . . 0.0 111.54 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 41' ' ' PRO . 0.9 OUTLIER 75.05 2.68 4.02 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.719 -0.613 . . . . 0.0 109.373 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -93.2 -71.26 0.66 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 55.16 89.42 0.11 Allowed Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.656 -0.652 . . . . 0.0 109.518 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 49' ' ' GLY . 50.8 Cg_exo -54.37 -36.68 88.0 Favored 'Trans proline' 0 N--CA 1.499 1.801 0 C-N-CA 122.246 1.964 . . . . 0.0 111.238 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -58.96 -44.7 91.51 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -47.83 -32.71 6.42 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.345 -0.847 . . . . 0.0 109.921 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 25.5 p-90 -134.37 31.89 3.43 Favored 'General case' 0 N--CA 1.504 2.225 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -61.9 -76.86 0.22 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.052 -1.219 . . . . 0.0 110.052 -179.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.468 ' ND1' ' O ' ' A' ' 50' ' ' HIS . 62.7 t-80 55.19 3.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.686 -0.89 . . . . 0.0 110.447 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 49' ' ' GLY . . . 74.35 -18.29 2.2 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.535 HH11 ' HG3' ' A' ' 52' ' ' ARG . 8.9 ptm180 -61.08 -3.92 0.95 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.126 -1.22 . . . . 0.0 109.195 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 51' ' ' GLY . 58.8 tp -62.67 -44.25 96.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.315 -0.866 . . . . 0.0 108.806 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.6 p -65.13 -34.83 79.34 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.334 -0.854 . . . . 0.0 109.353 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -74.87 -33.53 62.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.024 . . . . 0.0 109.507 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.77 -46.79 86.4 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.873 -1.142 . . . . 0.0 109.585 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.0 -23.9 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.376 -0.827 . . . . 0.0 109.826 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.16 -32.1 71.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.28 -0.888 . . . . 0.0 109.433 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -70.88 -1.91 13.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.141 -0.974 . . . . 0.0 109.616 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -103.65 122.8 45.77 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.427 -0.795 . . . . 0.0 108.908 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.458 ' OD1' ' N ' ' A' ' 62' ' ' PHE . 40.2 p-10 -73.89 -37.5 64.68 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.414 -0.804 . . . . 0.0 111.582 -178.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.458 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 50.2 p90 -72.19 19.29 0.07 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 120.653 -1.28 . . . . 0.0 110.976 -178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.435 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.0 mt -137.62 125.86 23.14 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.442 -0.786 . . . . 0.0 108.974 178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.4 m -92.5 133.56 35.81 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -115.01 130.87 68.77 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.33 0 CA-C-O 121.545 0.688 . . . . 0.0 109.513 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -149.7 144.4 26.07 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -107.21 122.68 47.01 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.457 -0.777 . . . . 0.0 109.139 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.9 m -78.77 149.54 32.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 109.403 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -84.57 126.24 33.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.609 -0.682 . . . . 0.0 109.294 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.55 ' ND2' ' NE2' ' A' ' 75' ' ' HIS . 51.4 t30 -149.91 89.62 1.62 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.335 -0.853 . . . . 0.0 109.883 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 58.36 -140.67 46.67 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.0 p -86.5 -7.55 58.31 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.197 -1.178 . . . . 0.0 109.992 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -102.98 122.8 45.36 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.3 mt -87.15 129.4 34.95 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.55 ' NE2' ' ND2' ' A' ' 70' ' ' ASN . 17.4 m-70 -98.12 116.79 31.07 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.388 -0.82 . . . . 0.0 109.228 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.7 m -71.96 144.37 48.92 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.499 -0.751 . . . . 0.0 109.186 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -143.39 150.99 39.88 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 31.7 pt -143.22 149.58 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.609 -0.682 . . . . 0.0 109.74 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.68 ' NH2' ' H ' ' A' ' 26' ' ' TRP . 6.9 ptp180 -155.42 156.49 35.43 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.5 137.22 46.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.893 . . . . 0.0 109.26 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 45.0 ttp180 -63.51 -42.14 98.49 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.527 -0.733 . . . . 0.0 109.935 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -56.94 -42.27 79.77 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.923 . . . . 0.0 109.804 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -79.61 -5.3 54.74 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.146 -0.971 . . . . 0.0 109.611 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.2 -3.02 90.74 Favored Glycine 0 N--CA 1.497 2.73 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.59 126.94 31.86 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.01 -1.288 . . . . 0.0 109.388 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -76.37 145.87 39.13 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.436 -0.79 . . . . 0.0 110.121 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 50.18 95.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.283 -0.886 . . . . 0.0 110.325 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.42 133.18 41.2 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.271 -0.893 . . . . 0.0 109.485 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -78.51 -6.05 54.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.201 -0.937 . . . . 0.0 109.494 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -60.45 -42.67 96.64 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.196 -0.94 . . . . 0.0 109.65 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.482 ' O ' ' CG ' ' A' ' 92' ' ' HIS . 41.3 p-80 -151.73 15.68 0.67 Allowed 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.089 -1.007 . . . . 0.0 109.552 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.482 ' CG ' ' O ' ' A' ' 91' ' ' HIS . 33.9 p80 . . . . . 0 N--CA 1.503 2.225 0 CA-C-O 117.956 -1.021 . . . . 0.0 111.006 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.516 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -66.53 149.53 84.3 Favored 'Trans proline' 0 N--CA 1.499 1.799 0 C-N-CA 122.178 1.918 . . . . 0.0 112.044 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 p80 -150.27 146.4 26.76 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.288 -0.882 . . . . 0.0 109.076 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -82.43 -83.17 0.13 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.193 -0.942 . . . . 0.0 109.796 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -171.3 146.33 2.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.435 -0.79 . . . . 0.0 109.084 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.59 -78.17 0.05 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.475 -0.766 . . . . 0.0 109.8 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -50.2 150.46 4.35 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.26 -0.9 . . . . 0.0 110.261 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -49.52 134.68 32.95 Favored 'Trans proline' 0 N--CA 1.498 1.778 0 C-N-CA 121.412 1.408 . . . . 0.0 112.148 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.8 mp -64.56 -41.35 96.36 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 108.989 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -56.39 -48.27 77.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 109.81 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -65.11 -39.2 92.77 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.193 -0.942 . . . . 0.0 109.477 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 6.5 ttt -62.78 -53.02 60.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -69.94 -41.82 74.07 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.914 -1.116 . . . . 0.0 109.763 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.6 -47.57 83.2 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.078 -1.014 . . . . 0.0 109.855 -179.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.8 m -62.26 -44.27 96.92 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.291 -0.881 . . . . 0.0 110.208 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.52 -48.12 50.8 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.055 -1.028 . . . . 0.0 110.548 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -62.78 -44.1 99.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.026 -1.046 . . . . 0.0 109.461 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.25 -35.33 80.13 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.176 -0.953 . . . . 0.0 110.01 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.43 -57.9 8.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.067 -1.021 . . . . 0.0 110.621 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.4 m -97.06 27.26 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 121.323 -0.861 . . . . 0.0 110.063 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -55.39 -32.78 62.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.961 -1.087 . . . . 0.0 110.08 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.671 ' HG3' HH11 ' A' ' 22' ' ' ARG . 9.4 mtt85 48.65 -94.93 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.973 -1.079 . . . . 0.0 110.096 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' N ' ' O ' ' A' ' 21' ' ' ALA . 67.8 t0 -62.69 -53.27 56.94 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.273 -0.892 . . . . 0.0 111.189 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.45 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 80.9 p -171.39 -160.24 0.17 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.199 -0.938 . . . . 0.0 109.567 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -50.21 -17.78 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.096 -1.202 . . . . 0.0 110.096 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -82.43 136.59 34.91 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.161 -1.2 . . . . 0.0 108.974 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.88 145.34 31.54 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.47 -0.769 . . . . 0.0 109.328 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.02 131.53 48.92 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.27 -0.894 . . . . 0.0 109.551 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.6 tp -57.2 -39.88 76.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.244 -0.91 . . . . 0.0 109.554 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.9 p -57.74 -41.4 81.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.112 -0.993 . . . . 0.0 109.201 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.83 85.59 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.373 -0.83 . . . . 0.0 109.761 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.18 -48.46 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 109.477 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.66 -48.02 84.66 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.91 -43.85 97.69 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.291 -1.123 . . . . 0.0 109.638 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.539 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 87.6 t80 -60.35 -46.36 90.2 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.186 -0.946 . . . . 0.0 109.263 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.53 -38.92 92.99 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.42 -0.8 . . . . 0.0 109.173 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.34 -46.84 76.38 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.536 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -64.47 -44.17 91.87 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.266 -0.897 . . . . 0.0 109.517 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.539 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.4 m-80 -65.4 -40.14 93.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.318 -0.864 . . . . 0.0 110.362 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -90.76 167.15 16.97 Favored Pre-proline 0 N--CA 1.505 2.293 0 O-C-N 121.317 -0.865 . . . . 0.0 108.979 -179.265 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.08 -45.06 43.8 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.497 1.465 . . . . 0.0 111.252 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 t -179.03 88.67 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.426 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 36.4 t80 -61.38 174.4 0.73 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.336 -0.852 . . . . 0.0 109.05 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -133.4 76.18 68.43 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 121.485 -0.759 . . . . 0.0 110.15 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.56 -37.96 94.6 Favored 'Trans proline' 0 N--CA 1.499 1.842 0 C-N-CA 122.194 1.929 . . . . 0.0 111.932 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 64.9 mtm-85 -60.65 -37.24 80.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.606 -0.684 . . . . 0.0 109.233 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -59.61 -40.02 86.15 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -82.55 31.47 0.41 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.378 -0.826 . . . . 0.0 108.993 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.92 169.75 4.98 Favored Glycine 0 N--CA 1.495 2.586 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -68.16 -39.42 82.62 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.462 -1.022 . . . . 0.0 109.652 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -141.6 8.51 2.57 Favored Glycine 0 N--CA 1.504 3.194 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.7 ttt180 -68.1 -12.27 60.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.169 -1.195 . . . . 0.0 108.639 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 53.2 tp -61.79 -40.38 94.99 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.1 p -60.79 -36.95 80.28 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.349 -0.844 . . . . 0.0 109.032 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -69.37 -36.81 77.22 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.377 -0.827 . . . . 0.0 110.12 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 14.1 tpt -61.22 -47.81 84.41 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.897 -1.127 . . . . 0.0 109.871 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -71.45 -25.46 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.119 -0.988 . . . . 0.0 109.394 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -62.4 -32.55 73.39 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.374 -0.829 . . . . 0.0 109.513 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -64.04 -33.44 75.76 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.411 -0.806 . . . . 0.0 108.874 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.1 mt -73.02 142.53 47.7 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.391 -0.818 . . . . 0.0 109.433 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.7 p-10 -90.62 -34.62 15.39 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.282 -0.886 . . . . 0.0 111.273 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.411 ' N ' ' OD1' ' A' ' 61' ' ' ASP . 40.4 p90 -73.04 16.27 0.17 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.678 -1.264 . . . . 0.0 110.396 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.437 ' H ' ' C ' ' A' ' 61' ' ' ASP . 11.1 mt -134.06 127.2 31.73 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.1 m -95.16 134.8 37.49 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -118.04 131.27 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 O-C-N 121.608 -0.682 . . . . 0.0 109.468 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -140.24 137.42 34.25 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.461 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -94.57 134.78 36.76 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -0.793 . . . . 0.0 109.291 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 68.7 m -117.37 129.92 56.18 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.644 -0.66 . . . . 0.0 109.346 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -75.11 138.44 42.08 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.775 -1.203 . . . . 0.0 109.735 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -151.0 92.05 1.77 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.72 -140.71 48.05 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.8 p -84.43 -6.21 59.36 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.44 -1.035 . . . . 0.0 110.356 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -123.2 97.72 5.55 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.508 -0.745 . . . . 0.0 109.852 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.9 134.52 50.96 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -103.41 128.35 50.56 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.53 -0.731 . . . . 0.0 109.677 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.5 t -71.29 154.35 41.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.633 -0.667 . . . . 0.0 109.601 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -136.56 145.65 45.23 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.3 pt -132.35 157.1 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -143.51 147.54 34.64 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.483 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -82.79 119.24 24.1 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -179.953 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.483 ' N ' HD13 ' A' ' 80' ' ' LEU . 79.4 ttt-85 -57.32 126.71 28.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.24 -0.912 . . . . 0.0 109.765 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.61 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 79.8 t60 -171.7 -179.32 2.47 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.61 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 95.2 m-20 53.69 32.05 13.92 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.526 -0.734 . . . . 0.0 109.837 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.91 9.08 54.79 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 85' ' ' LEU . 10.1 mp 53.67 177.86 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.152 -1.205 . . . . 0.0 109.119 -179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 87' ' ' HIS . 9.2 tm-20 -165.04 117.29 1.19 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.006 -1.058 . . . . 0.0 109.125 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.459 ' ND1' ' N ' ' A' ' 88' ' ' HIS . 63.3 t-80 55.66 165.92 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.489 0.662 . . . . 0.0 109.963 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.501 ' ND1' ' N ' ' A' ' 89' ' ' HIS . 62.3 t-80 -82.63 161.77 22.1 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.151 -0.968 . . . . 0.0 109.197 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.501 ' N ' ' ND1' ' A' ' 88' ' ' HIS . 36.5 p-80 -154.39 157.11 38.03 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.063 -1.023 . . . . 0.0 109.491 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -80.2 152.93 28.89 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.437 -0.79 . . . . 0.0 109.836 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 51.99 94.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.549 -0.719 . . . . 0.0 110.208 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 92' ' ' HIS . 46.9 p-80 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.614 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.547 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 1' ' ' MET . 34.7 Cg_exo -62.34 144.99 95.93 Favored 'Trans proline' 0 N--CA 1.5 1.863 0 C-N-CA 122.268 1.979 . . . . 0.0 112.293 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.0 p-80 -157.53 123.77 4.83 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -89.12 -10.64 46.53 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.03 -1.044 . . . . 0.0 109.189 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.76 123.38 17.82 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.086 -1.009 . . . . 0.0 108.873 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -134.87 27.56 3.58 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.558 -0.714 . . . . 0.0 109.144 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.55 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -68.18 -42.45 30.51 Favored Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.334 -0.854 . . . . 0.0 109.886 179.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 34.7 Cg_exo -61.52 138.79 78.07 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.217 1.945 . . . . 0.0 111.738 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.485 HD22 ' N ' ' A' ' 9' ' ' LEU . 3.6 mm? -64.96 -41.96 95.02 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.184 -0.948 . . . . 0.0 108.991 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -65.22 -45.64 83.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 109.86 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -64.64 -35.84 82.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.66 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.5 ttt -61.71 -61.43 2.52 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.29 -0.881 . . . . 0.0 109.852 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -66.86 -40.31 87.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.069 -1.019 . . . . 0.0 110.256 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.9 m -61.75 -46.07 91.21 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.774 -1.204 . . . . 0.0 109.883 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 61.5 m -59.45 -44.22 93.01 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.039 -1.038 . . . . 0.0 109.966 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.72 -46.75 62.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.116 -0.99 . . . . 0.0 110.67 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.479 ' O ' ' N ' ' A' ' 21' ' ' ALA . 98.1 mt -62.56 -45.16 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 109.509 -179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -67.6 -32.51 73.3 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.093 -1.004 . . . . 0.0 109.093 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.08 -25.71 67.92 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.29 -0.882 . . . . 0.0 109.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.1 m -131.89 19.43 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.423 -0.798 . . . . 0.0 110.335 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -60.86 -24.75 66.16 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.887 -1.133 . . . . 0.0 108.893 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.1 mtt180 51.81 178.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.472 -0.768 . . . . 0.0 110.267 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -68.73 -18.67 64.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.617 -0.677 . . . . 0.0 110.038 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.7 m -74.45 -6.11 46.42 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.901 -1.124 . . . . 0.0 109.469 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -52.51 1.97 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.448 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 96.5 m95 -61.73 178.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.28 -1.13 . . . . 0.0 109.274 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.83 133.13 14.5 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -73.49 132.07 42.49 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.248 -0.907 . . . . 0.0 109.354 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 49.4 tp -54.76 -38.45 67.21 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.238 -0.914 . . . . 0.0 109.546 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -57.94 -44.9 87.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.908 -1.12 . . . . 0.0 109.34 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.07 -41.01 99.35 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.122 -0.986 . . . . 0.0 109.414 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 82.5 t -62.36 -48.14 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.257 -0.902 . . . . 0.0 109.106 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.33 -49.17 76.78 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.9 m -61.32 -43.01 99.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.133 -1.216 . . . . 0.0 109.813 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.566 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 69.6 t80 -60.79 -47.35 86.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.253 -0.905 . . . . 0.0 109.385 -179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' A' ' 40' ' ' ASP . 80.5 mt -63.0 -40.74 98.67 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.114 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.447 ' O ' ' N ' ' A' ' 41' ' ' PRO . . . -57.51 -48.22 79.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.116 -0.99 . . . . 0.0 109.247 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -61.76 -41.24 97.44 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.204 -0.935 . . . . 0.0 109.132 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.566 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.2 m-80 -80.23 -9.81 59.74 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.277 -0.889 . . . . 0.0 109.269 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.0 t0 -164.57 71.31 1.55 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.266 -0.896 . . . . 0.0 109.457 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.447 ' N ' ' O ' ' A' ' 37' ' ' ALA . 52.4 Cg_exo -57.14 -30.71 88.07 Favored 'Trans proline' 0 N--CA 1.498 1.788 0 C-N-CA 122.595 2.197 . . . . 0.0 111.489 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.7 t -57.11 -13.58 3.08 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.606 -0.684 . . . . 0.0 110.183 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -92.22 -55.51 3.4 Favored 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 t0 54.44 85.56 0.19 Allowed Pre-proline 0 N--CA 1.498 1.94 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -54.77 -49.15 17.72 Favored 'Trans proline' 0 N--CA 1.499 1.804 0 C-N-CA 122.328 2.019 . . . . 0.0 112.511 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.498 ' HG2' HH11 ' A' ' 46' ' ' ARG . 66.1 mtp85 -53.19 -52.97 57.11 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.446 -0.784 . . . . 0.0 109.36 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -66.57 -35.09 79.36 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 19.7 t90 -79.34 3.39 18.35 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.193 -0.942 . . . . 0.0 109.777 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.8 126.95 1.01 Allowed Glycine 0 N--CA 1.497 2.714 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -65.91 -45.35 82.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.091 -1.241 . . . . 0.0 109.068 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -147.8 1.91 0.72 Allowed Glycine 0 N--CA 1.5 2.938 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -66.03 -3.29 5.12 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.236 . . . . 0.0 109.278 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 59.2 tp -66.25 -41.6 89.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.122 -0.986 . . . . 0.0 108.668 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 t -59.8 -44.17 94.11 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.438 -0.789 . . . . 0.0 109.66 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -68.09 -30.47 69.65 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.221 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -63.36 -46.97 84.09 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.179 -0.95 . . . . 0.0 109.83 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 57' ' ' VAL . 17.1 m -71.75 -21.09 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.159 -0.963 . . . . 0.0 109.788 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -59.42 -31.99 69.77 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.147 -0.971 . . . . 0.0 109.557 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -73.47 -3.23 26.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.093 -1.004 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.7 mt -100.22 110.23 22.48 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.368 -0.833 . . . . 0.0 108.862 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.7 t0 -66.12 -37.36 85.53 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 111.523 -179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 38.1 p90 -71.48 20.03 0.06 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.727 -1.233 . . . . 0.0 110.981 -178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.2 mt -139.34 127.89 23.05 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.223 -0.923 . . . . 0.0 108.954 178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 85.2 m -90.13 133.2 35.02 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.355 -0.84 . . . . 0.0 109.017 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.7 t -120.94 130.73 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.675 -0.641 . . . . 0.0 109.45 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.448 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.6 mt-30 -144.73 153.2 41.44 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.461 -0.774 . . . . 0.0 109.077 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -103.79 144.67 31.17 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.418 -0.801 . . . . 0.0 110.265 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 42.3 t -131.16 132.14 44.54 Favored 'General case' 0 N--CA 1.497 1.898 0 CA-C-O 121.638 0.732 . . . . 0.0 109.273 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.668 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.0 OUTLIER -70.21 131.59 44.45 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.542 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 39.7 t-20 -148.69 104.72 3.5 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 120.845 -1.159 . . . . 0.0 109.347 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.28 -140.84 45.45 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 32.1 t -85.22 -3.43 58.81 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.331 -1.099 . . . . 0.0 110.563 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -134.18 120.39 20.01 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.25 -0.906 . . . . 0.0 109.605 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.75 140.05 58.83 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.678 -0.809 . . . . 0.0 108.828 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.542 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.7 m-70 -102.46 124.32 47.8 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.3 p -71.44 156.63 39.24 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.491 -0.756 . . . . 0.0 109.035 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.45 149.3 39.07 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.9 pt -142.26 153.92 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.53 -0.731 . . . . 0.0 109.685 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -152.32 152.68 32.41 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.299 -0.875 . . . . 0.0 108.801 178.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -69.74 135.08 49.33 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.438 ' N ' HD13 ' A' ' 80' ' ' LEU . 41.3 ttp180 -59.29 -46.57 88.2 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.225 -0.922 . . . . 0.0 109.825 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.606 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 11.6 t-160 -71.54 -137.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.114 -0.991 . . . . 0.0 109.048 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.606 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 96.4 m-20 50.79 -175.54 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.063 -1.023 . . . . 0.0 109.846 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.34 -159.5 51.56 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.512 ' N ' HD22 ' A' ' 85' ' ' LEU . 3.4 mm? 50.72 28.68 3.72 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 109.342 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.75 137.14 50.31 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.423 -0.798 . . . . 0.0 109.681 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -78.19 156.88 29.58 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.488 -0.758 . . . . 0.0 109.517 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -71.97 143.86 49.08 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.244 -0.91 . . . . 0.0 109.309 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -69.02 130.43 42.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.184 -0.948 . . . . 0.0 109.783 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -67.68 -36.2 80.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.478 -0.764 . . . . 0.0 109.85 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -50.75 145.54 6.83 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.329 -0.857 . . . . 0.0 110.383 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.467 179.896 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.531 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.7 mpt? . . . . . 0 N--CA 1.492 1.651 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -61.3 146.99 96.74 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.543 2.162 . . . . 0.0 112.327 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -87.94 117.58 26.9 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.258 -0.901 . . . . 0.0 108.913 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -80.12 138.11 36.86 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.101 -0.999 . . . . 0.0 109.502 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -58.87 95.67 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 109.093 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -80.3 -1.91 42.96 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.325 -0.86 . . . . 0.0 108.957 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -47.63 151.49 1.47 Allowed Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.162 -0.962 . . . . 0.0 109.715 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -55.46 122.66 12.13 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.855 1.703 . . . . 0.0 112.05 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.06 -39.6 93.49 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.647 -0.658 . . . . 0.0 109.527 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -53.84 -48.37 70.01 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.349 -0.845 . . . . 0.0 109.831 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.01 -40.4 94.87 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.221 -0.924 . . . . 0.0 109.341 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 40.8 ttm -61.85 -51.53 67.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.099 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -70.29 -40.37 74.31 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.7 m -61.82 -48.36 80.97 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.11 -0.994 . . . . 0.0 109.705 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.3 m -62.57 -42.9 99.84 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.155 -0.966 . . . . 0.0 110.262 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.02 -48.29 58.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.035 -1.041 . . . . 0.0 111.034 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.435 ' O ' ' N ' ' A' ' 21' ' ' ALA . 95.3 mt -63.1 -45.35 98.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.093 -1.004 . . . . 0.0 109.789 -178.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -65.2 -34.24 77.9 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.706 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.05 -39.1 93.72 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.261 -0.899 . . . . 0.0 110.066 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.568 ' C ' ' H ' ' A' ' 22' ' ' ARG . 14.8 m -114.02 16.25 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 O-C-N 121.614 -0.679 . . . . 0.0 110.321 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -63.0 15.55 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 O-C-N 120.68 -1.263 . . . . 0.0 110.041 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.568 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.0 mtp180 -61.13 -142.29 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.028 -1.045 . . . . 0.0 109.912 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 54.12 -88.5 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.133 -0.979 . . . . 0.0 109.17 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 22' ' ' ARG . 88.5 p -160.58 72.31 0.46 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.74 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.14 -60.88 1.04 Allowed Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -53.78 178.63 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.324 -1.104 . . . . 0.0 109.821 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -152.8 129.38 10.75 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.13 127.03 29.99 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.141 -0.974 . . . . 0.0 109.47 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.3 tp -57.45 -39.2 75.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.4 -0.812 . . . . 0.0 109.155 -178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.7 m -57.11 -42.05 80.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.167 -0.958 . . . . 0.0 109.262 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.51 91.35 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.143 -0.973 . . . . 0.0 109.322 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.0 t -62.9 -47.95 90.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.17 -0.956 . . . . 0.0 109.224 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.98 -49.79 69.11 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -62.22 -42.33 99.21 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -1.132 . . . . 0.0 109.611 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 84.3 t80 -60.75 -46.43 90.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.231 -0.918 . . . . 0.0 109.446 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 40' ' ' ASP . 73.2 mt -63.15 -40.01 96.33 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.876 . . . . 0.0 109.122 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 109.275 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.04 -43.13 96.46 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 109.595 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 82.9 m-20 -90.51 4.66 50.49 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.242 -0.911 . . . . 0.0 109.136 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' A' ' 36' ' ' LEU . 21.8 t70 -168.23 77.24 0.85 Allowed Pre-proline 0 N--CA 1.489 1.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.44 -28.14 52.76 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.137 1.891 . . . . 0.0 111.331 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.1 t -63.32 -15.53 57.63 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.462 -0.773 . . . . 0.0 109.587 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -75.01 131.3 40.53 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.227 -0.921 . . . . 0.0 109.085 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 18.6 p30 -138.45 83.07 21.5 Favored Pre-proline 0 N--CA 1.5 2.059 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -58.7 -24.78 72.66 Favored 'Trans proline' 0 N--CA 1.501 1.933 0 C-N-CA 122.497 2.131 . . . . 0.0 110.511 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.464 ' HE ' ' CD2' ' A' ' 50' ' ' HIS . 45.2 mmm-85 -67.42 -42.52 83.06 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.846 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -72.77 -12.13 60.88 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.291 -0.88 . . . . 0.0 109.153 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 31.2 m95 -81.7 -2.83 51.89 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.21 -0.931 . . . . 0.0 109.581 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.12 13.81 7.48 Favored Glycine 0 N--CA 1.508 3.484 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.464 ' CD2' ' HE ' ' A' ' 46' ' ' ARG . 17.0 m80 56.24 110.73 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.653 -0.91 . . . . 0.0 110.736 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.75 -6.47 12.35 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -66.93 -7.75 24.41 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.386 -1.067 . . . . 0.0 109.034 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.35 -42.79 99.68 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.8 t -62.44 -43.61 98.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 109.539 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.429 ' N ' ' CD ' ' A' ' 55' ' ' GLN . 25.9 mp0 -71.54 -27.9 63.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.312 -0.868 . . . . 0.0 109.395 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 44.7 ttp -67.67 -47.12 70.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.096 -1.002 . . . . 0.0 109.804 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.4 m -72.69 -14.85 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.068 -1.02 . . . . 0.0 109.702 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -59.32 -26.82 65.33 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.425 -0.797 . . . . 0.0 109.83 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -80.59 -3.69 51.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.05 -1.031 . . . . 0.0 109.418 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 62.9 mt -99.07 110.22 22.84 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.471 ' C ' ' H ' ' A' ' 63' ' ' LEU . 92.2 m-20 -64.58 -39.02 92.99 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.403 -0.811 . . . . 0.0 111.325 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -70.27 21.16 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.718 -1.239 . . . . 0.0 111.199 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.471 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.8 mt -138.21 131.9 31.01 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.192 -0.942 . . . . 0.0 108.978 178.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 86.8 m -93.43 134.83 35.27 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.322 -0.861 . . . . 0.0 108.689 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 67.6 t -122.62 131.17 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.473 -0.767 . . . . 0.0 109.244 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.0 tt0 -150.68 153.68 36.05 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.437 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.6 pm0 -149.92 154.22 37.94 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.292 -0.88 . . . . 0.0 109.066 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 70' ' ' ASN . 45.1 t -143.85 132.23 22.09 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.452 -0.78 . . . . 0.0 109.35 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.553 ' CG ' HH11 ' A' ' 69' ' ' ARG . 0.8 OUTLIER -64.55 84.0 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' SER . 98.2 m-20 -98.6 142.94 29.55 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.382 -0.824 . . . . 0.0 109.544 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.53 -142.78 42.72 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.6 t -100.72 9.6 42.23 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.671 -0.899 . . . . 0.0 109.585 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.442 ' O ' ' ND1' ' A' ' 75' ' ' HIS . 36.6 ttmt -138.16 139.1 39.21 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.34 -0.85 . . . . 0.0 109.971 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.3 tp -66.44 128.95 38.18 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.442 ' ND1' ' O ' ' A' ' 73' ' ' LYS . 64.6 m80 -108.24 104.66 14.11 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.7 m -85.31 150.14 24.97 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.483 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -144.79 149.26 35.17 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.367 -0.833 . . . . 0.0 108.951 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.8 pt -135.08 152.25 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.725 -0.609 . . . . 0.0 109.467 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -141.04 155.81 46.12 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.48 94.31 6.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.877 . . . . 0.0 108.886 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 37.01 53.7 1.16 Allowed 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.533 0.682 . . . . 0.0 111.03 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -86.78 66.81 9.62 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.817 -1.177 . . . . 0.0 108.645 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -83.62 114.43 21.54 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.77 146.96 2.25 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.5 mt -64.29 -41.76 96.73 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.275 -1.132 . . . . 0.0 109.166 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -170.71 -74.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.435 -0.791 . . . . 0.0 109.002 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -76.31 171.74 14.05 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.214 -0.929 . . . . 0.0 109.59 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -163.81 120.37 1.7 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.321 -0.862 . . . . 0.0 108.873 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.9 t60 50.41 82.49 0.05 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.286 -0.884 . . . . 0.0 109.896 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -73.45 138.32 45.09 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.49 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -71.63 141.27 49.96 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.243 -0.911 . . . . 0.0 109.794 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 50.4 p-80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.604 179.865 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.6 mtt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -60.82 145.41 99.04 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.471 2.114 . . . . 0.0 112.402 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -65.82 -45.5 82.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.305 -0.872 . . . . 0.0 109.713 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -78.92 137.06 37.46 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.248 -0.908 . . . . 0.0 109.834 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -94.09 114.5 26.66 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.373 -0.829 . . . . 0.0 109.093 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.05 31.4 1.44 Allowed 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.123 -0.986 . . . . 0.0 108.511 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 m170 -54.11 152.34 11.14 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.263 -0.898 . . . . 0.0 109.269 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -44.85 129.87 9.78 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.651 1.567 . . . . 0.0 112.086 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.99 -41.77 95.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.493 -0.755 . . . . 0.0 109.361 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.462 ' NE2' ' OG1' ' A' ' 14' ' ' THR . 19.9 tm0? -56.33 -48.77 76.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.326 -0.859 . . . . 0.0 109.41 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.01 -34.66 78.21 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttt -62.62 -52.56 62.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.301 -0.874 . . . . 0.0 110.328 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -69.45 -42.01 75.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.908 -1.12 . . . . 0.0 109.829 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.462 ' OG1' ' NE2' ' A' ' 10' ' ' GLN . 97.0 m -61.63 -44.45 96.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.845 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.1 t -61.67 -45.02 95.8 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.087 -1.008 . . . . 0.0 110.218 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.3 -46.11 51.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.261 -0.899 . . . . 0.0 110.897 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.05 -45.55 98.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.165 -0.959 . . . . 0.0 109.902 -178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -69.22 -32.81 72.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.245 -0.909 . . . . 0.0 109.834 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.13 -40.25 94.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.255 -0.903 . . . . 0.0 110.391 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.477 ' C ' ' H ' ' A' ' 22' ' ' ARG . 10.6 m -100.05 6.31 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.318 0 O-C-N 121.253 -0.905 . . . . 0.0 109.742 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.0 8.5 0.27 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.032 -1.043 . . . . 0.0 109.461 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.477 ' H ' ' C ' ' A' ' 20' ' ' VAL . 10.5 mtp180 -61.83 -40.5 95.51 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.078 -1.014 . . . . 0.0 109.859 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.502 ' C ' ' HG ' ' A' ' 24' ' ' SER . 37.0 p-10 -73.89 121.43 20.93 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.076 -1.015 . . . . 0.0 109.549 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' C ' ' A' ' 23' ' ' ASP . 96.3 p 47.38 -91.78 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.389 -0.82 . . . . 0.0 110.445 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 23' ' ' ASP . . . -159.41 -59.04 0.01 OUTLIER Glycine 0 N--CA 1.494 2.558 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.432 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 81.9 m95 -55.27 -177.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.396 -1.061 . . . . 0.0 109.872 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.08 135.06 32.19 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.636 -0.665 . . . . 0.0 109.239 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -71.31 134.83 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.257 -0.902 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 63.5 tp -55.6 -40.86 72.6 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 109.287 -179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 t -59.57 -43.8 93.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.112 -0.992 . . . . 0.0 108.991 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.53 -37.15 86.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.237 -0.914 . . . . 0.0 109.664 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 73.5 t -61.72 -48.86 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.09 -1.006 . . . . 0.0 109.132 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.07 -45.15 92.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.465 ' HB2' HH21 ' A' ' 46' ' ' ARG . 7.4 t -61.68 -44.28 97.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.859 -1.377 . . . . 0.0 109.832 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.547 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 71.6 t80 -57.98 -43.91 86.83 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.247 -0.908 . . . . 0.0 109.409 -179.123 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.3 mt -63.3 -40.3 96.98 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.337 -0.852 . . . . 0.0 108.992 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.089 -1.007 . . . . 0.0 109.192 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -61.04 -42.52 98.63 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.303 -0.873 . . . . 0.0 109.497 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.547 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.1 m-80 -83.01 -6.07 59.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.275 -0.891 . . . . 0.0 108.714 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -153.69 74.01 6.51 Favored Pre-proline 0 N--CA 1.495 1.799 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.25 -35.31 73.51 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.288 1.992 . . . . 0.0 111.204 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 81.6 p -66.57 -10.98 50.88 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.539 -0.725 . . . . 0.0 109.415 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -88.36 148.32 24.31 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.277 -0.889 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -129.45 78.18 76.1 Favored Pre-proline 0 N--CA 1.502 2.145 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.524 ' O ' ' N ' ' A' ' 49' ' ' GLY . 41.7 Cg_endo -78.21 -27.3 5.6 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.724 1.616 . . . . 0.0 110.83 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.465 HH21 ' HB2' ' A' ' 34' ' ' SER . 25.2 mmt180 -65.02 -45.25 86.3 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.439 -0.788 . . . . 0.0 109.192 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -48.6 -30.85 5.81 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.319 -0.863 . . . . 0.0 110.295 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 15.0 p-90 -135.62 25.19 3.42 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.252 -0.905 . . . . 0.0 109.829 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.524 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -87.43 -11.54 68.81 Favored Glycine 0 N--CA 1.5 2.958 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -66.5 -40.74 89.42 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.006 -1.291 . . . . 0.0 109.425 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.646 ' O ' ' N ' ' A' ' 53' ' ' LEU . . . -139.89 -147.94 5.11 Favored Glycine 0 N--CA 1.502 3.073 0 N-CA-C 108.739 -1.744 . . . . 0.0 108.739 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.414 HH11 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mtt-85 49.0 -74.84 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.218 0 CA-C-N 117.53 0.665 . . . . 0.0 110.535 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.646 ' N ' ' O ' ' A' ' 51' ' ' GLY . 64.7 tp -51.18 -41.67 60.36 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.098 -1.001 . . . . 0.0 108.571 179.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.1 p -63.98 -29.66 70.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.484 -0.76 . . . . 0.0 109.137 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -85.87 -29.3 23.8 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.265 -0.897 . . . . 0.0 109.562 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.7 mtt -63.61 -41.4 98.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.158 -0.964 . . . . 0.0 109.15 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 6.7 m -61.47 -41.42 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.242 -0.911 . . . . 0.0 108.93 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.65 -31.98 72.36 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.332 -0.855 . . . . 0.0 109.692 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -89.56 -2.38 58.32 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.109 -0.994 . . . . 0.0 110.417 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 62' ' ' PHE . 6.3 mt -88.09 5.4 41.32 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.203 -0.936 . . . . 0.0 109.196 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.509 ' C ' ' H ' ' A' ' 63' ' ' LEU . 66.6 t0 56.55 -75.77 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.781 -0.574 . . . . 0.0 111.793 178.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 60' ' ' LEU . 47.6 p90 -65.52 26.95 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.623 -1.298 . . . . 0.0 111.848 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 61' ' ' ASP . 1.2 mm? -124.86 126.81 46.15 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 120.948 -1.095 . . . . 0.0 108.351 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.1 m -88.45 141.93 28.13 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.54 131.14 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.503 -0.748 . . . . 0.0 109.371 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.432 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 27.2 mt-30 -145.53 155.3 42.99 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 38.8 mp0 -114.58 123.95 50.63 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 89.8 p -109.44 150.92 27.38 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 130.54 34.76 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.589 0.709 . . . . 0.0 109.367 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -152.1 112.81 4.17 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.414 -0.804 . . . . 0.0 109.263 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.41 -144.64 47.41 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 88.4 p -92.92 1.92 57.05 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.509 -0.994 . . . . 0.0 109.864 -179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -123.71 135.94 54.16 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.487 -0.758 . . . . 0.0 109.935 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 73.6 mt -75.41 132.42 40.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.7 m170 -104.89 117.03 33.02 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.569 -0.707 . . . . 0.0 109.114 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.0 t -68.12 139.28 56.17 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.371 -0.83 . . . . 0.0 109.476 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -126.26 143.74 51.04 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.9 pt -135.37 158.44 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.742 -0.599 . . . . 0.0 110.07 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -147.98 139.8 23.94 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -60.38 106.76 0.57 Allowed 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -65.95 140.74 58.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 109.957 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -76.69 11.08 1.81 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.36 -0.838 . . . . 0.0 109.313 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' C ' ' H ' ' A' ' 85' ' ' LEU . 61.9 t0 55.6 35.28 24.88 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.592 -0.693 . . . . 0.0 109.787 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -75.79 31.85 1.25 Allowed Glycine 0 N--CA 1.495 2.598 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.453 HD23 ' N ' ' A' ' 86' ' ' GLU . 2.3 tt -89.16 115.36 26.62 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.092 -1.24 . . . . 0.0 108.325 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.453 ' N ' HD23 ' A' ' 85' ' ' LEU . 79.0 tt0 51.51 96.88 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.244 -0.91 . . . . 0.0 110.086 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -72.43 138.99 47.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 109.565 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -73.91 141.63 46.0 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.315 -0.865 . . . . 0.0 109.17 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 80.6 m80 -73.64 140.97 46.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.142 -0.974 . . . . 0.0 109.644 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.99 137.95 45.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.327 -0.858 . . . . 0.0 110.001 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 48.51 74.86 0.16 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.442 -0.786 . . . . 0.0 110.481 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.447 ' CG ' ' OXT' ' A' ' 92' ' ' HIS . 56.9 t-80 . . . . . 0 N--CA 1.494 1.741 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.01 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.7 mtm . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -61.13 145.84 98.31 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.408 2.072 . . . . 0.0 112.039 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -122.33 145.32 48.37 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -72.14 138.71 47.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.344 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.5 tp10 -102.5 -23.35 13.91 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.6 mtmm -88.67 -6.25 57.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.09 -1.007 . . . . 0.0 109.014 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -171.46 77.08 0.51 Allowed Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 121.531 -0.73 . . . . 0.0 109.046 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -57.67 143.47 95.01 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.317 2.012 . . . . 0.0 112.192 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 50.4 mt -63.8 -41.2 97.96 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -58.88 -39.6 81.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.259 -0.901 . . . . 0.0 109.255 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -61.82 -43.54 98.65 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.3 -0.875 . . . . 0.0 109.129 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.2 mtt -63.89 -46.76 83.45 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.208 -0.933 . . . . 0.0 109.868 -179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -69.74 -44.12 70.91 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.228 -0.92 . . . . 0.0 109.918 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.6 m -63.28 -47.2 83.36 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.2 -0.937 . . . . 0.0 110.147 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.7 p -66.5 -40.27 89.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 110.133 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.059 -1.026 . . . . 0.0 110.603 -179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -62.71 -44.45 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.349 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.73 -33.54 75.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 110.063 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 -58.92 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.134 -0.979 . . . . 0.0 110.467 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -98.31 29.48 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 O-C-N 121.314 -0.866 . . . . 0.0 109.453 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -48.91 -33.6 11.11 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.011 -1.056 . . . . 0.0 109.659 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.758 ' HG2' HH11 ' A' ' 22' ' ' ARG . 40.8 ttp85 51.92 -87.48 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.466 -0.771 . . . . 0.0 110.605 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.478 ' N ' ' O ' ' A' ' 21' ' ' ALA . 95.9 m-20 -60.74 -88.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.892 -1.13 . . . . 0.0 109.989 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 26' ' ' TRP . 31.6 t -167.99 97.95 0.45 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.099 -1.001 . . . . 0.0 109.363 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 78.5 -25.69 2.38 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.402 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.2 m95 -91.51 142.69 27.38 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.209 -1.171 . . . . 0.0 109.607 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.48 141.7 29.75 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.305 -0.872 . . . . 0.0 108.945 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -67.54 130.36 42.8 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 121.291 -0.881 . . . . 0.0 109.728 -179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 60.7 tp -55.72 -39.47 71.13 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.349 -0.844 . . . . 0.0 109.225 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 t -58.6 -44.0 89.73 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.098 -1.001 . . . . 0.0 109.173 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.32 87.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.154 -0.966 . . . . 0.0 109.684 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 89.1 t -62.09 -48.98 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.078 -1.014 . . . . 0.0 109.387 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.47 -44.39 97.73 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.813 -1.315 . . . . 0.0 109.813 -179.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -69.64 -40.33 76.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 109.804 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.513 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 70.7 t80 -61.71 -48.52 80.39 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.249 -0.907 . . . . 0.0 109.637 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 40' ' ' ASP . 85.0 mt -63.09 -42.14 99.55 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.232 -0.918 . . . . 0.0 108.954 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.29 -42.64 87.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.907 . . . . 0.0 109.084 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -64.97 -42.85 94.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 109.383 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.513 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 71.5 m-80 -84.78 -4.64 59.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.171 -0.955 . . . . 0.0 109.352 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.467 ' N ' ' O ' ' A' ' 36' ' ' LEU . 7.9 m-20 -154.74 74.24 5.78 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.278 -0.889 . . . . 0.0 108.884 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.0 -35.18 80.09 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.377 2.051 . . . . 0.0 111.286 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.8 t -65.4 -12.47 52.58 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.47 136.12 56.75 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.301 -0.874 . . . . 0.0 108.784 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.438 ' O ' ' ND2' ' A' ' 47' ' ' ASN . 66.2 m-20 -120.45 92.26 47.41 Favored Pre-proline 0 N--CA 1.502 2.141 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -73.17 -8.31 21.85 Favored 'Trans proline' 0 N--CA 1.49 1.283 0 C-N-CA 121.175 1.25 . . . . 0.0 111.49 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.758 HH11 ' HG3' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -66.85 -41.9 86.63 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.566 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.556 ' O ' ' NH2' ' A' ' 52' ' ' ARG . 17.1 p30 -70.48 -22.09 62.7 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.528 -0.733 . . . . 0.0 109.549 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.523 ' CE3' ' SD ' ' A' ' 56' ' ' MET . 89.7 m95 -93.61 3.81 54.93 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.131 -0.981 . . . . 0.0 109.112 -179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.35 138.74 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.42 -1.072 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -68.22 -36.27 79.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.139 -1.212 . . . . 0.0 110.267 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -95.62 -34.83 5.87 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.556 ' NH2' ' O ' ' A' ' 47' ' ' ASN . 46.3 ttp180 -63.93 -17.51 63.31 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.547 -0.973 . . . . 0.0 109.247 -178.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.3 tp -62.9 -43.05 99.83 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -64.83 -27.6 68.99 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.226 -0.921 . . . . 0.0 109.499 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -80.86 -34.28 33.86 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.139 -0.976 . . . . 0.0 109.4 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.523 ' SD ' ' CE3' ' A' ' 48' ' ' TRP . 47.3 ttp -61.48 -45.75 92.93 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.9 m -60.94 -31.3 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.28 -0.888 . . . . 0.0 109.487 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -64.6 -30.65 71.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.349 -0.844 . . . . 0.0 109.896 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -86.94 -7.04 58.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.998 -1.064 . . . . 0.0 110.164 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 92.7 mt -101.36 127.08 48.16 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.322 -0.861 . . . . 0.0 109.051 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.489 ' O ' ' CG ' ' A' ' 62' ' ' PHE . 97.3 m-20 -65.24 -168.91 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.244 -0.91 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CG ' ' O ' ' A' ' 61' ' ' ASP . 54.5 p90 42.89 16.51 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 122.028 -0.42 . . . . 0.0 111.427 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 61' ' ' ASP . 0.4 OUTLIER -132.83 116.37 16.44 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.247 -0.908 . . . . 0.0 108.792 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.407 ' N ' HD13 ' A' ' 63' ' ' LEU . 85.1 m -91.98 141.02 29.08 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 60.5 t -114.84 130.01 70.03 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-O 121.525 0.679 . . . . 0.0 109.621 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -154.23 143.74 21.51 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 67' ' ' GLU . 40.3 mp0 -108.92 152.25 25.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.646 -0.659 . . . . 0.0 109.438 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.5 m -127.38 131.37 50.34 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.605 ' HD3' ' N ' ' A' ' 69' ' ' ARG . 0.1 OUTLIER -77.52 136.63 38.34 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 -178.462 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -149.56 101.2 3.07 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.154 -0.966 . . . . 0.0 109.367 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.73 -141.77 47.81 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 84.0 p -86.97 -3.97 59.13 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.488 -1.007 . . . . 0.0 109.953 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.508 ' HD2' ' HE2' ' A' ' 75' ' ' HIS . 37.8 ttmt -115.71 121.81 43.62 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.675 -0.641 . . . . 0.0 110.143 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 tt -82.46 130.11 35.04 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.508 ' HE2' ' HD2' ' A' ' 73' ' ' LYS . 38.0 m80 -110.22 124.55 51.79 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.517 -0.739 . . . . 0.0 109.694 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.5 m -72.01 151.92 42.82 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.518 -0.739 . . . . 0.0 109.294 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -138.78 151.74 47.33 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.1 pt -137.17 156.45 33.91 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.623 0.725 . . . . 0.0 109.525 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 65.9 ttp85 -157.81 151.04 23.29 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.1 mt -70.33 139.52 52.03 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.217 -0.927 . . . . 0.0 109.435 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -68.67 89.89 0.39 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.221 -0.925 . . . . 0.0 109.935 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.473 ' O ' ' N ' ' A' ' 84' ' ' GLY . 86.5 t60 -157.6 159.07 36.68 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 108.812 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 52.15 -89.17 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.376 -0.828 . . . . 0.0 110.009 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 82' ' ' HIS . . . 79.72 -155.45 39.21 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.493 HD23 ' H ' ' A' ' 85' ' ' LEU . 0.2 OUTLIER -79.68 135.11 36.46 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.272 -1.134 . . . . 0.0 109.168 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -164.63 -32.11 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.202 -0.936 . . . . 0.0 109.061 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -81.1 -10.12 59.71 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.453 -0.78 . . . . 0.0 109.366 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -59.64 -39.44 84.34 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.475 -0.765 . . . . 0.0 109.398 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -54.28 -31.17 53.19 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.173 -0.954 . . . . 0.0 109.668 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -57.86 -43.33 85.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 109.465 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.12 -42.71 88.84 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.242 -0.911 . . . . 0.0 109.894 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 85.7 t60 . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 117.854 -1.07 . . . . 0.0 109.379 -179.507 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.563 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.731 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 1' ' ' MET . 31.6 Cg_exo -61.85 145.96 96.77 Favored 'Trans proline' 0 N--CA 1.499 1.841 0 C-N-CA 122.324 2.016 . . . . 0.0 112.21 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.472 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 57.8 t-80 52.0 47.5 24.63 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.313 -0.867 . . . . 0.0 110.322 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -154.51 41.75 0.48 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.18 -0.95 . . . . 0.0 109.278 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.31 140.52 55.95 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.941 . . . . 0.0 109.136 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt 49.94 -167.11 0.03 OUTLIER 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.333 -0.855 . . . . 0.0 109.745 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.506 ' HE2' ' CE ' ' A' ' 12' ' ' MET . 61.4 t60 -152.3 70.58 7.59 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.31 -0.869 . . . . 0.0 109.111 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.42 142.68 98.66 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 122.063 1.842 . . . . 0.0 111.752 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.23 -43.34 95.22 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.17 -0.956 . . . . 0.0 109.221 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -65.03 -45.36 85.76 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.39 -0.819 . . . . 0.0 109.4 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.49 -30.39 70.71 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.352 -0.842 . . . . 0.0 109.406 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.506 ' CE ' ' HE2' ' A' ' 7' ' ' HIS . 20.8 ttt -61.33 -66.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.307 -0.871 . . . . 0.0 109.803 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -64.32 -41.94 96.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.321 -0.862 . . . . 0.0 110.157 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -60.07 -46.32 89.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.963 -1.086 . . . . 0.0 109.862 -179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.4 m -61.27 -44.69 96.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.021 -1.049 . . . . 0.0 110.201 -179.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.29 -43.55 70.19 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.161 -0.962 . . . . 0.0 110.529 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.38 -45.21 98.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.195 -0.94 . . . . 0.0 109.677 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -67.91 -35.39 78.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.327 -0.858 . . . . 0.0 109.848 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.74 -38.31 90.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.193 -0.942 . . . . 0.0 110.113 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 22' ' ' ARG . 8.3 m -98.4 3.99 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.226 0 O-C-N 121.345 -0.847 . . . . 0.0 109.566 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.05 14.47 0.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.049 -1.032 . . . . 0.0 109.55 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 20' ' ' VAL . 7.2 mtp180 -46.85 164.41 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.143 -0.973 . . . . 0.0 110.684 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -48.66 96.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.574 0.702 . . . . 0.0 110.117 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.7 m -164.77 -70.67 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.362 -0.836 . . . . 0.0 108.87 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 159.52 120.58 0.57 Allowed Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 24.7 m95 45.87 -121.85 1.06 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.552 -0.97 . . . . 0.0 109.995 179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -167.45 117.44 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.046 -1.034 . . . . 0.0 108.762 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -62.57 131.63 49.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.137 -0.977 . . . . 0.0 109.637 -179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.5 -38.28 66.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.4 -0.813 . . . . 0.0 109.448 -178.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 t -58.48 -43.35 88.94 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.208 -0.932 . . . . 0.0 108.973 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.36 90.79 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.301 -0.875 . . . . 0.0 109.47 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.42 -49.4 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.158 -0.963 . . . . 0.0 109.217 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.41 -48.38 79.06 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 52.9 m -62.26 -43.18 99.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.298 -1.119 . . . . 0.0 109.85 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -61.29 -45.26 95.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.337 -0.852 . . . . 0.0 109.685 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.79 -41.14 97.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.869 . . . . 0.0 109.293 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.78 -45.19 82.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.278 -0.889 . . . . 0.0 109.245 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -65.39 -45.58 83.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -0.916 . . . . 0.0 109.809 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.459 HD22 ' N ' ' A' ' 39' ' ' ASN . 1.4 m-80 -64.6 -40.51 95.64 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.154 -0.966 . . . . 0.0 109.651 -179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 43' ' ' PHE . 0.0 OUTLIER -88.02 160.08 47.07 Favored Pre-proline 0 N--CA 1.501 2.101 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.394 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.41 -38.02 56.03 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.917 1.745 . . . . 0.0 111.416 179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 56.4 m -170.36 76.88 0.08 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.247 -0.908 . . . . 0.0 109.437 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.5 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 37.4 t80 -59.58 169.56 1.28 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.298 -0.876 . . . . 0.0 109.498 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -127.19 76.05 76.53 Favored Pre-proline 0 N--CA 1.503 2.211 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -73.12 -24.02 17.52 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 121.556 1.504 . . . . 0.0 111.396 -179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.548 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.5 mtt85 -65.77 -38.77 89.95 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 178.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -61.24 -37.82 84.43 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.507 ' HA ' HH21 ' A' ' 52' ' ' ARG . 78.1 m95 -87.78 6.47 35.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.317 -0.864 . . . . 0.0 109.169 -179.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.39 125.01 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.226 -1.55 . . . . 0.0 109.226 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -62.63 -12.67 24.68 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -1.142 . . . . 0.0 109.543 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' O ' ' NE2' ' A' ' 55' ' ' GLN . . . -113.87 -43.24 0.81 Allowed Glycine 0 N--CA 1.505 3.281 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.507 HH21 ' HA ' ' A' ' 48' ' ' TRP . 55.3 ttp85 -66.97 -11.47 56.83 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.567 -0.96 . . . . 0.0 108.882 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.66 -42.1 99.43 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.6 p -62.39 -39.08 92.06 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.381 -0.824 . . . . 0.0 109.086 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' O ' ' A' ' 51' ' ' GLY . 3.7 mp0 -72.72 -30.29 64.06 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.386 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 15.8 tpt -64.91 -47.43 77.81 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.973 -1.08 . . . . 0.0 109.503 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.2 m -72.93 -18.92 18.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 109.495 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -61.62 -28.79 69.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.456 -0.777 . . . . 0.0 109.789 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -74.52 -1.25 20.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.158 -0.964 . . . . 0.0 109.262 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 50.8 mt -100.87 119.35 38.55 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.461 -0.775 . . . . 0.0 108.999 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 63' ' ' LEU . 34.1 p-10 -74.11 -36.77 64.25 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.234 -0.917 . . . . 0.0 111.417 -179.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -72.15 19.18 0.07 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.703 -1.248 . . . . 0.0 110.978 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 61' ' ' ASP . 13.8 mt -136.72 129.59 30.79 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.207 -0.933 . . . . 0.0 109.205 179.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 87.6 m -88.51 133.37 34.17 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.213 -0.929 . . . . 0.0 108.778 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -125.72 132.81 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.527 -0.733 . . . . 0.0 109.608 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.548 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 3.3 pt20 -153.62 154.52 34.36 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -104.41 118.01 35.56 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.357 -0.839 . . . . 0.0 108.822 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 15.3 m -87.62 152.31 22.27 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.71 134.21 36.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.384 -0.822 . . . . 0.0 109.613 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.552 ' ND2' ' CD2' ' A' ' 75' ' ' HIS . 38.1 t-20 -150.72 93.57 1.97 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.006 -1.059 . . . . 0.0 109.185 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 56.54 -141.67 41.5 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.9 t -87.0 -7.7 57.9 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.29 -1.123 . . . . 0.0 109.895 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -106.34 127.88 53.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.404 -0.81 . . . . 0.0 109.742 -179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.7 mt -75.15 133.53 41.47 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.552 ' CD2' ' ND2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -106.89 120.37 41.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.4 m -74.98 146.36 41.73 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.498 -0.751 . . . . 0.0 109.271 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -142.03 150.24 41.04 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.365 -0.834 . . . . 0.0 108.927 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 40.0 pt -140.0 157.22 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 121.467 0.651 . . . . 0.0 109.408 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.0 ttp85 -149.02 147.93 29.13 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 110.94 16.07 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.018 -1.051 . . . . 0.0 109.247 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -54.79 -93.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.57 -0.706 . . . . 0.0 109.848 -179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.439 ' CG ' ' O ' ' A' ' 82' ' ' HIS . 54.9 t-80 48.07 46.46 19.36 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.095 -1.003 . . . . 0.0 109.72 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 85.9 m-20 -62.6 -123.76 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.529 -0.732 . . . . 0.0 109.684 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.57 10.4 86.23 Favored Glycine 0 N--CA 1.493 2.451 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.3 mt -88.54 -2.23 58.48 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.301 -1.117 . . . . 0.0 109.001 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 59.51 146.69 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.637 0.732 . . . . 0.0 110.174 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -75.05 133.85 41.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.321 -0.862 . . . . 0.0 109.22 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -150.84 149.17 29.37 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.268 -0.895 . . . . 0.0 109.225 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -68.53 135.32 51.38 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.173 -0.954 . . . . 0.0 109.739 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -76.93 -8.73 57.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.501 -0.75 . . . . 0.0 109.567 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -71.44 141.27 50.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.287 -0.883 . . . . 0.0 109.986 -179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 62.1 t-80 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.557 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.433 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 10.5 ptp . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 1' ' ' MET . 32.6 Cg_endo -61.53 145.18 98.06 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 122.252 1.968 . . . . 0.0 112.074 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -71.28 132.09 44.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.572 -0.705 . . . . 0.0 109.814 -179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -166.87 -51.61 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.322 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -153.7 -7.84 0.16 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.23 -0.919 . . . . 0.0 108.951 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.95 153.36 40.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.32 -0.862 . . . . 0.0 109.663 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 63.74 149.62 0.11 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.754 -0.591 . . . . 0.0 109.756 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -45.45 158.03 0.25 Allowed 'Trans proline' 0 N--CA 1.494 1.514 0 C-N-CA 121.62 1.546 . . . . 0.0 112.21 179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.9 mp -62.09 -40.39 95.67 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -54.39 -41.52 69.33 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.25 -0.906 . . . . 0.0 109.294 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -63.32 -42.91 99.02 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.317 -0.864 . . . . 0.0 109.264 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 26.8 ttt -62.04 -52.21 64.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.009 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -69.14 -42.13 76.38 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.03 -1.043 . . . . 0.0 110.038 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.8 m -62.05 -45.66 92.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.217 -0.927 . . . . 0.0 109.844 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.5 m -60.74 -42.38 97.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 109.7 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.38 95.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 110.354 -179.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 21' ' ' ALA . 96.5 mt -61.93 -45.91 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.887 -1.133 . . . . 0.0 109.474 -179.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -66.73 -34.92 78.91 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.198 -0.939 . . . . 0.0 109.565 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.69 -28.59 68.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.102 -0.998 . . . . 0.0 110.08 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 m -136.73 27.93 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.47 -0.769 . . . . 0.0 109.715 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -62.88 -23.26 67.25 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.839 -1.163 . . . . 0.0 109.025 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 55.52 -168.98 0.08 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.247 0.546 . . . . 0.0 110.378 179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -58.92 -48.19 82.33 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.228 -0.92 . . . . 0.0 110.565 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.9 m -71.65 151.29 43.81 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.912 -1.117 . . . . 0.0 109.359 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.01 -0.9 66.42 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -100.27 147.66 25.52 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.64 -0.917 . . . . 0.0 109.508 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.0 126.43 39.53 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.481 ' HG3' ' H ' ' A' ' 31' ' ' ALA . 12.8 pt-20 -63.44 138.89 58.68 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.235 -0.916 . . . . 0.0 109.638 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.597 HD23 ' OG ' ' A' ' 76' ' ' SER . 0.1 OUTLIER -54.31 -38.42 65.94 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.455 -0.778 . . . . 0.0 109.241 -178.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 60.6 m -55.91 -44.46 78.27 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 109.628 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.481 ' H ' ' HG3' ' A' ' 28' ' ' GLU . . . -66.38 -38.95 88.69 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.136 -0.978 . . . . 0.0 109.552 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.8 -50.2 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.001 -1.062 . . . . 0.0 109.369 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.09 97.99 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -59.8 -44.21 94.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.179 -1.189 . . . . 0.0 109.493 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -60.97 -47.69 85.29 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.77 -39.67 94.82 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.388 -0.82 . . . . 0.0 109.021 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.7 -45.52 81.76 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.14 -0.975 . . . . 0.0 109.591 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -60.1 -48.54 81.29 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.233 -0.917 . . . . 0.0 109.345 -179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -65.96 -40.19 91.07 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.309 -0.87 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.03 151.08 75.69 Favored Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.223 -0.923 . . . . 0.0 109.185 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -62.3 -35.04 75.87 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.697 1.598 . . . . 0.0 111.57 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.6 m -171.58 80.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.747 -0.596 . . . . 0.0 109.394 179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -88.37 -76.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 63.19 91.13 0.08 OUTLIER Pre-proline 0 N--CA 1.498 1.928 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -62.48 -17.55 58.59 Favored 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 121.374 1.383 . . . . 0.0 111.375 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -56.89 -47.46 80.43 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.364 -0.835 . . . . 0.0 109.026 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' A' ' 49' ' ' GLY . 98.1 m-20 -62.12 -33.8 75.14 Favored 'General case' 0 C--N 1.294 -1.808 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 27.1 m95 -75.96 26.55 0.12 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.176 -0.953 . . . . 0.0 109.783 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 51' ' ' GLY . . . 69.45 95.82 0.05 OUTLIER Glycine 0 N--CA 1.492 2.429 0 C-N-CA 119.964 -1.112 . . . . 0.0 110.371 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 49.27 -90.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.41 -1.053 . . . . 0.0 110.457 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 49' ' ' GLY . . . -157.76 62.9 0.32 Allowed Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -58.7 -5.7 0.62 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.405 -1.056 . . . . 0.0 109.053 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 53' ' ' LEU . 8.9 mp -62.59 -39.48 93.86 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.3 p -55.89 -33.27 64.46 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.527 -0.733 . . . . 0.0 109.795 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -85.54 -33.58 21.72 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.268 -0.895 . . . . 0.0 109.157 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 28.2 ttt -66.03 -43.79 86.54 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.098 -1.001 . . . . 0.0 109.816 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.3 m -67.62 -22.36 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.187 -0.945 . . . . 0.0 109.81 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -62.55 -21.91 65.93 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.489 -0.757 . . . . 0.0 109.202 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -86.21 6.64 28.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.284 -0.885 . . . . 0.0 109.79 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' PHE . 95.4 mt -93.59 -11.64 31.32 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.11 -0.993 . . . . 0.0 109.41 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 63' ' ' LEU . 22.9 t0 61.3 -61.56 0.09 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.804 -0.56 . . . . 0.0 111.778 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.497 ' N ' ' O ' ' A' ' 60' ' ' LEU . 49.2 p90 -65.82 22.03 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.66 -1.275 . . . . 0.0 112.138 -178.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 61' ' ' ASP . 7.6 mt -136.59 133.27 36.15 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.261 -0.899 . . . . 0.0 109.181 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 91.6 m -88.11 138.1 31.75 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 83.1 t -123.65 132.71 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.303 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -131.4 132.24 44.23 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -120.58 123.14 42.13 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.9 t -109.95 134.2 52.36 Favored 'General case' 0 N--CA 1.507 2.395 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.512 ' NH1' ' HG2' ' A' ' 69' ' ' ARG . 0.0 OUTLIER -72.78 132.61 43.82 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.706 -1.246 . . . . 0.0 108.512 -179.121 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -148.85 91.24 1.84 Allowed 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.186 -0.946 . . . . 0.0 109.041 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.02 -135.99 28.44 Favored Glycine 0 N--CA 1.489 2.188 0 N-CA-C 109.734 -1.347 . . . . 0.0 109.734 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 87.4 p -86.56 -4.36 59.16 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.32 -1.106 . . . . 0.0 110.355 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -132.05 136.02 46.92 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.369 -0.832 . . . . 0.0 108.972 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -88.46 158.39 18.37 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 179.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -98.07 103.98 15.97 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.121 -0.987 . . . . 0.0 108.691 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.597 ' OG ' HD23 ' A' ' 29' ' ' LEU . 9.2 t -76.92 150.73 35.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 109.226 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -148.1 137.65 22.3 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.063 -1.023 . . . . 0.0 108.545 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 38.3 pt -117.86 145.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.348 0 CA-C-O 121.582 0.706 . . . . 0.0 109.728 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -159.02 142.22 14.65 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.291 -0.88 . . . . 0.0 108.63 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 82' ' ' HIS . 44.8 mt -69.21 137.01 52.86 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.211 -0.931 . . . . 0.0 108.91 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 34.1 ptt180 -68.55 7.39 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.609 -0.682 . . . . 0.0 110.119 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 80' ' ' LEU . 84.4 t60 -56.51 -40.29 74.76 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 109.749 -179.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 83' ' ' ASP . 17.2 p-10 -82.81 8.51 12.13 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.259 -0.901 . . . . 0.0 109.765 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.47 166.15 4.52 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.09 -176.1 0.19 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -1.108 . . . . 0.0 109.609 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 53.99 31.66 13.96 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.666 -0.646 . . . . 0.0 109.671 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 87' ' ' HIS . 84.1 t60 -158.85 43.2 0.25 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.42 -0.8 . . . . 0.0 108.998 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -150.81 9.48 0.6 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.371 -0.831 . . . . 0.0 109.299 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -64.91 -40.0 94.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 109.49 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -67.47 154.32 41.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.228 -0.92 . . . . 0.0 110.084 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 52.38 86.47 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.534 -0.729 . . . . 0.0 110.297 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.5 m80 . . . . . 0 N--CA 1.495 1.775 0 CA-C-O 117.965 -1.017 . . . . 0.0 109.913 179.647 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 mtt . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -44.25 135.41 8.63 Favored 'Trans proline' 0 N--CA 1.496 1.634 0 C-N-CA 121.474 1.449 . . . . 0.0 112.059 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -78.24 -93.2 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.278 -0.888 . . . . 0.0 109.521 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' C ' ' H ' ' A' ' 6' ' ' LYS . 70.9 mmtt -88.31 -152.29 0.22 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.319 -0.863 . . . . 0.0 109.25 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.413 ' O ' ' NE2' ' A' ' 7' ' ' HIS . 96.4 mt-10 -71.84 37.33 0.06 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 109.568 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' A' ' 4' ' ' LYS . 36.9 ttmt -78.21 -19.97 52.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.156 -0.965 . . . . 0.0 109.076 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' NE2' ' O ' ' A' ' 5' ' ' GLU . 16.1 m-70 63.7 150.51 0.11 Allowed Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.735 -0.603 . . . . 0.0 109.441 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -43.81 152.74 0.32 Allowed 'Trans proline' 0 N--CA 1.493 1.485 0 C-N-CA 121.804 1.669 . . . . 0.0 112.299 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.9 -40.99 99.26 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.432 -0.793 . . . . 0.0 109.231 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -60.8 -50.01 75.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -67.68 -30.85 70.48 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.869 . . . . 0.0 109.69 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 8.8 ttt -64.17 -63.97 1.01 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -63.06 -43.13 99.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.142 -0.974 . . . . 0.0 110.071 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.7 m -60.29 -45.87 91.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.973 -1.08 . . . . 0.0 109.838 -179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 69.4 m -61.93 -44.24 97.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.164 -0.96 . . . . 0.0 110.237 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.5 -46.2 60.37 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.999 -1.063 . . . . 0.0 110.857 -179.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.48 -46.09 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.101 -0.999 . . . . 0.0 109.921 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -67.79 -36.17 79.95 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.362 -0.836 . . . . 0.0 109.671 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.09 -39.56 93.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.125 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.7 m -99.55 -0.52 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.324 0 O-C-N 121.305 -0.872 . . . . 0.0 109.952 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.33 -47.17 86.43 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.031 -1.043 . . . . 0.0 108.613 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.413 ' C ' ' H ' ' A' ' 24' ' ' SER . 36.9 mtt180 48.57 34.81 5.28 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.761 0.791 . . . . 0.0 109.987 178.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 53.48 10.06 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.844 -0.535 . . . . 0.0 109.94 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 22' ' ' ARG . 85.9 p -79.36 165.77 22.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.27 -0.894 . . . . 0.0 109.602 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -56.52 110.33 2.02 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 38.3 m95 46.33 -163.56 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.569 -0.959 . . . . 0.0 110.424 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.82 133.79 40.16 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.53 -0.731 . . . . 0.0 109.179 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -69.15 133.86 48.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.914 . . . . 0.0 109.647 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 36.0 tp -58.38 -39.75 80.46 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.235 -0.916 . . . . 0.0 109.045 -179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -56.78 -41.3 77.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.254 -0.904 . . . . 0.0 109.257 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.68 88.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.264 -0.898 . . . . 0.0 109.576 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.3 -48.23 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.276 -0.89 . . . . 0.0 109.57 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.71 -46.85 93.37 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.3 m -62.76 -43.26 99.26 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.19 -1.183 . . . . 0.0 109.877 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE1' ' OD1' ' A' ' 39' ' ' ASN . 58.5 t80 -61.88 -47.03 86.82 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.197 -0.939 . . . . 0.0 109.655 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.456 ' O ' ' N ' ' A' ' 40' ' ' ASP . 75.0 mt -63.03 -41.1 99.44 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.294 -0.879 . . . . 0.0 109.168 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.43 -42.67 74.51 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.103 -0.998 . . . . 0.0 109.246 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.93 -42.86 94.31 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.337 -0.852 . . . . 0.0 109.386 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.455 ' OD1' ' CE1' ' A' ' 35' ' ' TYR . 8.2 m120 -88.9 6.5 38.95 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.325 -0.859 . . . . 0.0 109.492 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 36' ' ' LEU . 39.6 t0 -144.94 79.44 11.98 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.36 -0.837 . . . . 0.0 108.8 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -60.57 156.32 42.77 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.197 1.931 . . . . 0.0 111.865 -179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.9 p 70.43 -2.98 1.99 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.509 -0.744 . . . . 0.0 109.384 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -83.0 134.72 35.04 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.102 -0.999 . . . . 0.0 109.201 179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.97 88.32 44.57 Favored Pre-proline 0 N--CA 1.502 2.129 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -54.24 -35.16 82.28 Favored 'Trans proline' 0 N--CA 1.496 1.675 0 C-N-CA 121.856 1.704 . . . . 0.0 110.633 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 47.7 mmm-85 -60.19 -36.93 78.74 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.071 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 49' ' ' GLY . 6.4 m120 -63.3 -37.16 86.16 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.114 -0.991 . . . . 0.0 108.697 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -76.89 19.17 0.3 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.258 -0.901 . . . . 0.0 109.568 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 47' ' ' ASN . . . 88.11 156.19 30.24 Favored Glycine 0 N--CA 1.501 2.97 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ARG . 58.6 t-80 -78.48 111.64 14.72 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.316 -1.108 . . . . 0.0 109.703 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 57.35 6.1 2.02 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' HIS . 40.2 ttp180 -65.46 -1.02 2.2 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.288 -1.125 . . . . 0.0 109.145 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.475 HD12 ' N ' ' A' ' 53' ' ' LEU . 10.3 mp -62.66 -38.67 91.22 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.7 p -55.24 -33.08 62.83 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.335 -0.853 . . . . 0.0 109.768 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -80.1 -35.96 36.1 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.049 -1.032 . . . . 0.0 109.379 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.4 tpt -65.42 -45.63 83.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.067 -1.02 . . . . 0.0 109.501 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.38 -23.86 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.066 -1.021 . . . . 0.0 109.662 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -67.43 -21.69 65.55 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.525 -0.734 . . . . 0.0 109.856 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -91.75 -8.22 47.46 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.072 -1.018 . . . . 0.0 110.543 -178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mt -94.19 -7.21 42.86 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.986 -1.071 . . . . 0.0 108.197 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 46.86 55.15 8.21 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.742 -0.598 . . . . 0.0 110.931 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -151.51 9.28 0.54 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.892 -1.13 . . . . 0.0 110.575 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mt -137.84 149.03 45.97 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 71.7 m -86.72 122.92 31.3 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.4 t -111.51 118.72 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.061 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -144.25 142.63 30.59 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -94.43 152.43 18.61 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.35 -0.844 . . . . 0.0 109.394 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 32.3 t -143.16 131.11 21.64 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -73.35 130.49 40.28 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 109.763 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -152.46 155.04 36.72 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 109.618 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.15 -131.18 51.92 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.1 m -113.76 8.68 17.51 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.843 -0.798 . . . . 0.0 109.588 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -147.57 153.56 39.59 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.995 . . . . 0.0 110.061 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.6 tp -63.43 136.95 57.96 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.486 -0.759 . . . . 0.0 109.237 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -121.88 134.55 54.87 Favored 'General case' 0 N--CA 1.505 2.299 0 CA-C-O 121.644 0.735 . . . . 0.0 109.231 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.4 p -77.86 158.01 29.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.523 -0.736 . . . . 0.0 109.28 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -144.9 144.59 31.17 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 pt -133.07 151.51 34.25 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.723 -0.611 . . . . 0.0 109.448 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt180 -155.32 150.54 26.94 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.547 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -64.01 131.64 48.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.267 -0.896 . . . . 0.0 108.609 -179.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.547 ' N ' HD13 ' A' ' 80' ' ' LEU . 12.0 ptp180 -73.95 38.6 0.11 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.02 -1.05 . . . . 0.0 109.941 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.598 ' CG ' ' H ' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -78.34 -104.83 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.262 -0.899 . . . . 0.0 109.843 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.598 ' H ' ' CG ' ' A' ' 82' ' ' HIS . 31.6 t70 -63.73 134.31 55.1 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.061 -1.024 . . . . 0.0 109.865 -179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 167.5 -52.94 0.23 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.3 tp -63.05 -51.31 67.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.114 -1.227 . . . . 0.0 109.214 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 40.98 -146.6 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.739 -0.601 . . . . 0.0 110.499 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 75.9 m80 50.85 16.9 0.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.918 -1.114 . . . . 0.0 110.203 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -65.38 -41.02 94.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -0.914 . . . . 0.0 109.17 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -71.26 -20.69 62.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.179 -0.951 . . . . 0.0 109.505 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.43 ' ND1' ' O ' ' A' ' 90' ' ' HIS . 57.2 t-80 -73.99 44.0 0.17 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.352 -0.842 . . . . 0.0 109.458 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.16 -43.08 87.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.9 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 117.928 -1.034 . . . . 0.0 109.782 -179.705 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.9 mtt . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -61.22 146.5 97.38 Favored 'Trans proline' 0 N--CA 1.497 1.723 0 C-N-CA 122.403 2.069 . . . . 0.0 112.167 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 -157.13 3.21 0.13 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.279 -0.888 . . . . 0.0 109.03 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.4 mttp 50.93 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.521 -0.737 . . . . 0.0 110.123 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -66.1 -37.24 85.27 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.238 -0.914 . . . . 0.0 109.723 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -91.79 144.09 25.86 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.294 -0.879 . . . . 0.0 109.244 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 52.24 89.12 0.1 Allowed Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 109.105 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -54.68 146.41 54.72 Favored 'Trans proline' 0 N--CA 1.499 1.811 0 C-N-CA 121.731 1.62 . . . . 0.0 112.135 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 61.0 tp -62.23 -41.89 98.81 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.281 -0.887 . . . . 0.0 108.979 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -59.57 -39.84 85.41 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.143 -0.973 . . . . 0.0 109.088 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.17 -37.14 86.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.12 -0.988 . . . . 0.0 108.698 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 93.5 mtp -61.22 -48.01 83.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 109.841 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -68.97 -42.02 77.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.228 -0.92 . . . . 0.0 109.913 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.1 m -62.55 -50.11 72.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.015 -1.053 . . . . 0.0 110.009 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.4 t -66.37 -42.62 87.73 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.326 -0.859 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.1 65.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.154 -0.966 . . . . 0.0 111.526 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 93.0 mt -62.88 -44.61 99.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.838 -1.164 . . . . 0.0 109.584 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.493 ' OE1' ' N ' ' A' ' 18' ' ' GLU . 0.4 OUTLIER -66.37 -30.21 70.55 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.159 -0.963 . . . . 0.0 109.481 -179.897 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -48.48 75.47 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.132 -0.98 . . . . 0.0 110.721 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.46 18.01 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 121.352 -0.843 . . . . 0.0 109.841 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.507 ' HB1' ' O ' ' A' ' 24' ' ' SER . . . -60.45 -38.58 84.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 109.441 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 22' ' ' ARG . 32.6 mtm180 51.0 72.06 0.39 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 110.773 179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 51.78 36.8 18.75 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.429 -0.794 . . . . 0.0 110.203 178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.507 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 46.5 m -162.51 121.26 2.2 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.077 -1.014 . . . . 0.0 108.836 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -64.37 0.68 3.56 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.424 ' H ' ' C ' ' A' ' 24' ' ' SER . 99.3 m95 -99.7 145.93 27.08 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.505 -0.997 . . . . 0.0 108.95 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.01 143.85 31.39 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 35.3 mp0 -68.72 132.39 46.75 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.003 -1.061 . . . . 0.0 109.369 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.0 tp -55.09 -40.62 70.59 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.117 -0.989 . . . . 0.0 109.287 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -58.51 -43.76 89.24 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.249 -0.907 . . . . 0.0 108.909 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.03 -37.62 88.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.347 -0.845 . . . . 0.0 109.799 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 93.0 t -62.05 -49.5 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.228 -0.92 . . . . 0.0 109.527 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.11 -43.92 98.46 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.994 -1.243 . . . . 0.0 109.994 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.1 t -62.69 -45.18 93.98 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.001 -1.293 . . . . 0.0 109.927 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 86.8 t80 -60.96 -48.48 81.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.332 -0.855 . . . . 0.0 109.499 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 83.2 mt -64.71 -39.29 93.4 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.426 -0.796 . . . . 0.0 109.112 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.51 82.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.314 -0.866 . . . . 0.0 109.03 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.51 -44.15 91.83 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.23 -0.919 . . . . 0.0 109.639 179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 70.8 m-80 -64.58 -40.33 95.35 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.279 -0.888 . . . . 0.0 110.371 -179.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -92.84 153.21 42.1 Favored Pre-proline 0 N--CA 1.505 2.283 0 O-C-N 121.194 -0.941 . . . . 0.0 109.422 -179.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -47.69 -43.72 27.87 Favored 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.19 1.26 . . . . 0.0 111.73 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.2 m -168.97 77.71 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.517 ' CG ' ' N ' ' A' ' 44' ' ' ASP . 45.6 t80 -60.03 -176.19 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.172 -0.955 . . . . 0.0 109.582 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.517 ' N ' ' CG ' ' A' ' 43' ' ' PHE . 3.6 m-20 -145.72 87.97 6.67 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -80.71 -92.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 121.646 1.564 . . . . 0.0 111.245 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.445 ' C ' ' H ' ' A' ' 48' ' ' TRP . 10.3 ptm180 -66.9 -22.3 65.97 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.005 -1.059 . . . . 0.0 109.898 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -51.14 -10.34 0.08 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.072 -1.017 . . . . 0.0 109.795 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.508 ' CD1' ' O ' ' A' ' 44' ' ' ASP . 10.1 m0 -76.59 -25.96 54.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.188 -0.945 . . . . 0.0 108.95 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 168.06 -168.17 40.62 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -74.45 76.79 1.92 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.391 -1.064 . . . . 0.0 109.787 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.03 17.98 79.18 Favored Glycine 0 N--CA 1.498 2.831 0 N-CA-C 110.148 -1.181 . . . . 0.0 110.148 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.493 HH11 ' HG2' ' A' ' 52' ' ' ARG . 75.8 ttt-85 -62.51 -19.03 63.19 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.267 -1.137 . . . . 0.0 108.935 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.1 tp -62.32 -44.14 97.18 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.9 p -63.03 -35.03 78.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.543 -0.723 . . . . 0.0 109.213 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -77.5 -29.19 52.42 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.31 -0.868 . . . . 0.0 109.5 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.3 ttp -62.9 -46.4 88.02 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 109.284 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.67 -30.07 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.196 -0.94 . . . . 0.0 109.554 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.3 -35.95 78.74 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.187 -0.946 . . . . 0.0 109.8 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -64.34 -35.43 80.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.243 -0.911 . . . . 0.0 108.874 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -75.48 138.87 41.88 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.672 -0.642 . . . . 0.0 109.281 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -87.57 -32.72 19.2 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.408 -0.808 . . . . 0.0 111.324 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -76.29 18.0 0.33 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.911 -1.118 . . . . 0.0 110.764 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.4 mt -134.35 127.82 32.44 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.465 ' OG1' ' NE ' ' A' ' 81' ' ' ARG . 86.0 m -92.08 135.39 34.01 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.2 t -109.88 130.94 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.483 -0.76 . . . . 0.0 109.146 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -153.4 157.12 39.48 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.442 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 2.0 pm0 -145.86 155.81 43.13 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.051 -1.031 . . . . 0.0 108.558 -179.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 66.1 m -132.4 147.62 52.39 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.685 HH11 ' HG3' ' A' ' 69' ' ' ARG . 9.0 mtm-85 -76.52 140.91 41.34 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-O 121.394 0.616 . . . . 0.0 109.79 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -150.94 100.71 2.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.442 -0.786 . . . . 0.0 109.684 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 64.61 -139.09 40.89 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.3 p -89.29 4.62 48.21 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.398 -1.06 . . . . 0.0 109.868 -179.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -139.38 114.64 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.468 -0.77 . . . . 0.0 109.542 -179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -76.06 141.29 42.09 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -102.92 123.07 45.85 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.545 -0.722 . . . . 0.0 109.434 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.8 m -71.18 149.8 45.98 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.472 -0.768 . . . . 0.0 109.057 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -139.64 153.42 47.31 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 pt -141.39 156.45 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt-85 -137.84 147.96 45.0 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.26 117.9 29.35 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 83' ' ' ASP . 92.6 mtt-85 -64.22 -41.03 97.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.562 -0.711 . . . . 0.0 110.184 -178.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.2 t-80 61.81 -72.86 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 81' ' ' ARG . 93.1 m-20 -53.64 -90.27 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.309 -0.869 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 80.33 17.33 74.14 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.465 ' N ' HD22 ' A' ' 85' ' ' LEU . 4.1 mm? -86.1 -1.9 57.83 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.354 -1.086 . . . . 0.0 108.761 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.19 127.84 33.48 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.344 -0.847 . . . . 0.0 109.49 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -80.38 164.05 23.39 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.404 -0.81 . . . . 0.0 109.471 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -150.7 145.76 26.02 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.152 -0.968 . . . . 0.0 108.984 179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -87.74 132.24 34.21 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.081 -1.012 . . . . 0.0 109.704 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -66.61 -37.62 85.27 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.469 -0.77 . . . . 0.0 109.491 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -62.45 -40.51 96.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 84.6 t60 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.89 -1.052 . . . . 0.0 109.507 -179.591 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.9 mtm . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.0 148.52 92.56 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 122.659 2.239 . . . . 0.0 112.146 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -60.89 -41.52 96.2 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 108.953 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -157.52 56.93 0.5 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.256 -0.903 . . . . 0.0 109.117 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 48.58 89.26 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.158 -0.964 . . . . 0.0 109.965 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -90.77 31.83 1.03 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.113 -0.992 . . . . 0.0 109.994 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.539 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -73.28 -43.26 7.3 Favored Pre-proline 0 N--CA 1.5 2.048 0 O-C-N 121.242 -0.911 . . . . 0.0 109.506 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 22.1 Cg_exo -62.45 143.39 93.24 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 122.144 1.896 . . . . 0.0 112.145 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 52.2 mt -65.26 -42.02 93.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.383 -0.823 . . . . 0.0 109.233 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.28 -43.75 97.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 109.607 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -39.0 93.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.26 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.428 ' SD ' HD22 ' A' ' 36' ' ' LEU . 39.8 tpp -61.58 -53.84 51.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.294 -0.879 . . . . 0.0 109.814 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -70.16 -40.66 74.6 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.193 -0.942 . . . . 0.0 109.999 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 96.1 m -62.63 -45.55 92.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.068 -1.02 . . . . 0.0 109.661 -179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.2 p -60.17 -45.03 94.46 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.202 -0.936 . . . . 0.0 110.07 -179.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.46 -48.06 43.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.232 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.57 -44.61 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.126 -0.983 . . . . 0.0 109.475 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -66.27 -33.51 75.91 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.209 -0.932 . . . . 0.0 109.889 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.38 -59.15 3.63 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.182 -0.949 . . . . 0.0 110.706 -179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.8 m -96.72 29.97 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.427 0 O-C-N 121.345 -0.847 . . . . 0.0 109.918 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.75 -20.49 2.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.974 -1.079 . . . . 0.0 109.97 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.639 ' HG3' HH11 ' A' ' 22' ' ' ARG . 3.7 ttt85 60.21 43.4 13.98 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.594 -0.691 . . . . 0.0 109.24 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 41.58 37.49 0.72 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.782 -0.574 . . . . 0.0 111.192 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.6 p -143.82 9.32 1.53 Allowed 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.173 -0.954 . . . . 0.0 109.39 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.87 -43.73 0.98 Allowed Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.762 -1.335 . . . . 0.0 109.762 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.437 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 99.4 m95 -75.17 174.87 8.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.3 -1.117 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.35 145.43 22.75 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -71.28 127.44 32.56 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.468 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.03 -42.21 68.89 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.125 -0.984 . . . . 0.0 109.512 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 38.9 t -60.13 -43.29 95.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.227 -0.921 . . . . 0.0 109.069 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.02 81.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.245 -0.909 . . . . 0.0 109.75 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 94.3 t -61.79 -49.04 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 120.965 -1.084 . . . . 0.0 109.6 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.66 -49.56 77.3 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.3 m -64.98 -42.22 94.74 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.288 -1.125 . . . . 0.0 110.017 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.449 ' CZ ' ' ND2' ' A' ' 39' ' ' ASN . 63.5 t80 -60.56 -49.3 78.08 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.258 -0.901 . . . . 0.0 109.558 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.486 ' O ' ' N ' ' A' ' 40' ' ' ASP . 91.6 mt -63.1 -41.95 99.48 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.299 -0.876 . . . . 0.0 109.029 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.62 86.88 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.885 . . . . 0.0 109.288 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -64.5 -42.89 95.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.435 -0.79 . . . . 0.0 109.678 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.449 ' ND2' ' CZ ' ' A' ' 35' ' ' TYR . 71.3 m-80 -85.14 -2.93 58.58 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.226 -0.921 . . . . 0.0 109.531 -179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.486 ' N ' ' O ' ' A' ' 36' ' ' LEU . 23.9 t70 -161.14 75.79 2.5 Favored Pre-proline 0 N--CA 1.491 1.621 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.83 -27.34 52.53 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.141 1.894 . . . . 0.0 111.071 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.6 m -66.37 -8.21 24.08 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.566 -0.709 . . . . 0.0 109.397 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -69.31 134.23 48.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.352 -0.842 . . . . 0.0 109.254 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -117.85 91.04 38.16 Favored Pre-proline 0 N--CA 1.504 2.239 0 O-C-N 121.815 -0.553 . . . . 0.0 109.85 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.04 -17.34 30.85 Favored 'Trans proline' 0 N--CA 1.502 2.003 0 C-N-CA 122.148 1.899 . . . . 0.0 111.021 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 46' ' ' ARG . 78.4 mtt180 -63.98 -35.63 81.32 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-O 121.613 0.72 . . . . 0.0 109.229 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -61.36 -36.1 79.26 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CD1' ' N ' ' A' ' 48' ' ' TRP . 48.4 m95 -77.99 3.59 14.34 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' A' ' 50' ' ' HIS . . . 70.36 -1.71 18.58 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.456 ' O ' ' N ' ' A' ' 52' ' ' ARG . 72.9 t60 59.1 150.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.822 -0.81 . . . . 0.0 109.923 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.505 ' C ' ' H ' ' A' ' 53' ' ' LEU . . . 68.91 -65.24 0.48 Allowed Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.536 HH11 ' HG3' ' A' ' 52' ' ' ARG . 85.2 mtm-85 -59.58 2.45 0.07 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.68 -0.894 . . . . 0.0 109.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 51' ' ' GLY . 59.1 tp -57.77 -41.04 81.18 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.984 -1.073 . . . . 0.0 108.511 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.7 t -60.93 -41.97 97.25 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.447 -0.783 . . . . 0.0 108.946 178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.9 mm-40 -71.52 -30.22 65.68 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.874 -1.141 . . . . 0.0 109.796 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.9 mmm -63.17 -42.99 99.49 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.873 -1.142 . . . . 0.0 109.544 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.0 m -73.55 -22.92 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.089 -1.007 . . . . 0.0 109.734 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -61.92 -39.08 90.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.046 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -98.2 56.77 1.21 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.371 -0.83 . . . . 0.0 110.003 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 mt -146.14 -6.32 0.57 Allowed 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.508 ' O ' ' N ' ' A' ' 63' ' ' LEU . 23.0 t70 62.68 -174.15 0.15 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.344 -0.847 . . . . 0.0 110.134 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.488 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 31.1 p90 40.72 20.05 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.592 0 CA-C-O 121.295 0.569 . . . . 0.0 110.904 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.3 mt -141.97 131.63 24.07 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.214 -0.929 . . . . 0.0 109.472 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 81' ' ' ARG . 98.5 m -101.37 134.57 44.25 Favored 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 58.3 t -116.78 131.95 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 O-C-N 121.671 -0.643 . . . . 0.0 109.439 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.437 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 88.8 mt-30 -137.65 149.62 46.73 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -140.21 136.23 33.19 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.0 p -132.88 152.46 51.86 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.54 ' NH1' ' HG2' ' A' ' 69' ' ' ARG . 2.8 mtt-85 -89.11 130.66 35.52 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 75' ' ' HIS . 14.4 p-10 -150.31 114.45 5.11 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.019 -1.051 . . . . 0.0 109.619 179.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.4 -137.16 34.84 Favored Glycine 0 N--CA 1.495 2.59 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.3 p -93.47 -0.95 56.21 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.314 -1.109 . . . . 0.0 110.248 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' O ' ' OD1' ' A' ' 70' ' ' ASN . 68.5 mttm -134.81 139.35 45.03 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.376 -0.828 . . . . 0.0 109.684 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.65 151.08 37.82 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.232 -0.918 . . . . 0.0 109.077 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.47 ' CG ' ' OE2' ' A' ' 77' ' ' GLU . 19.5 t-160 -100.25 100.9 11.78 Favored 'General case' 0 N--CA 1.501 2.091 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.7 p -83.92 151.91 24.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.432 -0.793 . . . . 0.0 108.901 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.472 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 53.9 mp0 -146.44 153.59 40.63 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 pt -133.16 150.82 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.078 0 CA-C-O 121.398 0.618 . . . . 0.0 109.746 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -151.72 154.17 35.79 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.471 ' O ' ' CB ' ' A' ' 81' ' ' ARG . 60.4 mt -64.03 153.29 37.82 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.579 -0.701 . . . . 0.0 109.401 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 80' ' ' LEU . 9.0 tpp180 85.18 155.45 0.09 Allowed 'General case' 0 N--CA 1.509 2.512 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.466 ' H ' ' CD2' ' A' ' 82' ' ' HIS . 15.5 p80 -81.55 -30.29 33.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.244 -0.91 . . . . 0.0 109.074 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -166.95 -53.97 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.202 -0.936 . . . . 0.0 109.267 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.54 -28.22 8.63 Favored Glycine 0 N--CA 1.501 2.986 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.465 ' N ' HD22 ' A' ' 85' ' ' LEU . 4.0 mm? -78.75 145.39 34.46 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.209 -1.171 . . . . 0.0 109.689 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 57.38 109.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.61 0.719 . . . . 0.0 109.97 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -151.69 165.53 34.1 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 47.3 m170 51.98 -159.31 0.11 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.391 -0.818 . . . . 0.0 109.699 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 51.4 85.8 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.443 -0.786 . . . . 0.0 109.976 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -77.46 151.3 34.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.411 -0.805 . . . . 0.0 109.714 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -146.22 15.71 1.33 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.375 -0.828 . . . . 0.0 109.383 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 73.7 m80 . . . . . 0 N--CA 1.497 1.881 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.132 -179.912 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.5 ptt? . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.41 158.4 55.47 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.339 2.026 . . . . 0.0 112.07 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' O ' ' A' ' 4' ' ' LYS . 77.1 m80 -59.62 -36.47 76.39 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.322 -0.861 . . . . 0.0 109.971 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' O ' ' A' ' 3' ' ' HIS . 17.8 ttmm 55.45 108.82 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.708 0.766 . . . . 0.0 110.157 -179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -149.84 45.57 0.93 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.237 -0.914 . . . . 0.0 109.029 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -63.1 -43.67 97.84 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.329 -0.857 . . . . 0.0 109.698 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m80 -98.63 151.75 37.58 Favored Pre-proline 0 N--CA 1.501 2.109 0 O-C-N 121.49 -0.757 . . . . 0.0 109.107 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -46.06 139.03 12.06 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.713 1.608 . . . . 0.0 112.221 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.488 ' N ' HD12 ' A' ' 9' ' ' LEU . 10.2 mp -63.08 -41.6 99.45 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.326 -0.859 . . . . 0.0 108.798 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.529 ' NE2' ' NE2' ' A' ' 82' ' ' HIS . 57.3 tt0 -57.96 -38.51 76.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 109.153 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -63.09 -42.13 99.55 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.17 -0.956 . . . . 0.0 109.451 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.5 mmm -63.5 -47.41 81.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.065 -1.022 . . . . 0.0 109.677 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -72.65 -43.86 62.64 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.094 -1.003 . . . . 0.0 110.163 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.7 m -62.54 -50.14 72.53 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.122 -0.986 . . . . 0.0 110.331 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.3 m -64.84 -42.33 94.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.37 -0.831 . . . . 0.0 110.254 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.01 -49.18 48.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.54 -44.29 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 109.861 -179.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 49.9 tp10 -65.43 -33.82 76.84 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.73 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -39.43 93.54 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.081 -1.012 . . . . 0.0 110.027 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.3 m -101.29 16.91 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 O-C-N 121.448 -0.782 . . . . 0.0 110.038 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.1 11.41 9.78 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.966 -1.084 . . . . 0.0 108.774 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HD3' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -46.71 143.53 2.72 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.382 -0.823 . . . . 0.0 110.7 179.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.8 t0 56.05 24.66 8.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.848 -0.533 . . . . 0.0 110.169 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.0 m 51.65 -153.53 0.19 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.976 -1.078 . . . . 0.0 109.921 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.82 56.57 4.07 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.491 ' CZ2' ' OE1' ' A' ' 66' ' ' GLN . 36.6 m95 42.57 -139.48 0.18 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.779 -0.836 . . . . 0.0 110.624 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -158.71 138.52 11.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.022 -1.048 . . . . 0.0 108.692 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.87 125.37 28.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.127 -0.983 . . . . 0.0 109.286 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.447 ' O ' HD13 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -54.29 -39.27 66.79 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.346 -0.846 . . . . 0.0 109.104 -178.201 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.1 t -59.94 -43.94 94.68 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.777 -1.202 . . . . 0.0 108.885 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.29 -40.7 94.17 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.345 -0.847 . . . . 0.0 109.778 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.0 t -63.47 -51.0 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.132 -0.98 . . . . 0.0 109.678 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.67 -41.85 99.77 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.7 t -62.21 -44.43 96.59 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.15 -1.206 . . . . 0.0 109.694 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.559 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 76.9 t80 -57.45 -43.34 83.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 109.353 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 40' ' ' ASP . 87.0 mt -63.29 -38.16 90.09 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.234 -0.916 . . . . 0.0 108.93 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -53.69 -46.69 70.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.009 -1.057 . . . . 0.0 109.708 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -63.37 -40.17 96.52 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.081 -1.012 . . . . 0.0 109.174 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.559 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 80.1 m-20 -90.46 7.2 40.02 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.074 -1.016 . . . . 0.0 109.297 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 36' ' ' LEU . 56.2 t0 -164.71 57.83 0.56 Allowed Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 108.884 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 43' ' ' PHE . 27.7 Cg_endo -60.9 174.09 1.93 Allowed 'Trans proline' 0 N--CA 1.492 1.388 0 C-N-CA 122.091 1.86 . . . . 0.0 111.947 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 m 66.36 -6.61 0.48 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' A' ' 41' ' ' PRO . 47.8 t80 -94.41 -74.44 0.54 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.093 -1.004 . . . . 0.0 108.665 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 35.1 t0 63.91 91.51 0.08 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.432 ' O ' ' N ' ' A' ' 49' ' ' GLY . 51.2 Cg_exo -54.02 -38.32 86.78 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.84 1.694 . . . . 0.0 111.653 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -55.43 -39.11 69.86 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.602 -0.686 . . . . 0.0 109.916 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -49.8 -44.25 49.01 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.924 -1.11 . . . . 0.0 110.454 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.456 ' NE1' ' CZ ' ' A' ' 43' ' ' PHE . 49.0 p-90 -116.22 16.25 15.88 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.521 -0.737 . . . . 0.0 109.222 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -161.38 62.53 0.28 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.485 ' C ' ' H ' ' A' ' 52' ' ' ARG . 49.9 t-80 -69.27 98.9 1.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.515 -0.991 . . . . 0.0 109.1 179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 67.84 -38.92 0.24 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 110.049 -1.221 . . . . 0.0 110.049 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 50' ' ' HIS . 83.6 mtm-85 -66.9 -1.62 4.22 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -1.178 . . . . 0.0 109.442 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.32 -42.18 99.16 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 78.9 p -62.05 -27.48 68.92 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.24 -0.912 . . . . 0.0 109.445 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -81.87 -34.88 29.84 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.25 -0.906 . . . . 0.0 109.376 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -62.44 -41.07 98.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.248 -0.908 . . . . 0.0 109.53 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.83 -9.07 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.384 -0.822 . . . . 0.0 109.766 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -58.75 -30.76 67.75 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.158 -0.963 . . . . 0.0 109.698 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.22 -7.63 48.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.068 -1.02 . . . . 0.0 108.984 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.9 mt -93.82 110.63 22.27 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 120.96 -1.088 . . . . 0.0 108.891 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.445 ' C ' ' H ' ' A' ' 63' ' ' LEU . 67.1 t0 -65.09 -37.84 88.82 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.345 -0.847 . . . . 0.0 111.133 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -70.98 20.18 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 120.772 -1.205 . . . . 0.0 111.262 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 61' ' ' ASP . 10.5 mt -138.07 125.64 22.12 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.222 -0.924 . . . . 0.0 108.839 178.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 84.0 m -87.8 142.44 27.81 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.397 -0.814 . . . . 0.0 108.883 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.6 t -117.17 129.53 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.258 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.491 ' OE1' ' CZ2' ' A' ' 26' ' ' TRP . 49.3 tt0 -155.9 155.93 33.72 Favored 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' CD ' ' N ' ' A' ' 67' ' ' GLU . 1.8 pm0 -144.94 146.42 31.97 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.117 -0.989 . . . . 0.0 110.199 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 73.1 m -167.23 152.39 7.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.311 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.53 170.63 4.08 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -70.59 167.77 17.8 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 122.198 0.999 . . . . 0.0 111.056 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 60.69 -150.3 42.47 Favored Glycine 0 N--CA 1.484 1.858 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 89.9 p -96.44 6.92 47.75 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.47 -1.018 . . . . 0.0 109.271 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -87.77 150.62 23.46 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.079 -1.013 . . . . 0.0 109.504 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -123.86 122.9 39.21 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -91.13 137.19 32.56 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.327 -0.858 . . . . 0.0 108.907 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.8 m -71.21 140.89 50.62 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.811 -1.181 . . . . 0.0 109.13 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -149.87 136.43 19.17 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.271 -0.893 . . . . 0.0 109.144 179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.4 pt -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 O-C-N 121.339 -0.851 . . . . 0.0 109.8 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -144.32 145.95 32.3 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.532 HD13 ' H ' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -74.17 138.66 43.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.28 -0.887 . . . . 0.0 108.947 -179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.532 ' H ' HD13 ' A' ' 80' ' ' LEU . 12.7 tpt180 -65.94 3.59 0.79 Allowed 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.297 -0.877 . . . . 0.0 109.756 -179.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.529 ' NE2' ' NE2' ' A' ' 10' ' ' GLN . 9.2 m-70 -84.59 12.93 6.19 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.891 -1.131 . . . . 0.0 109.323 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -81.14 -0.9 42.26 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.311 -0.868 . . . . 0.0 109.747 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.17 -173.09 49.97 Favored Glycine 0 N--CA 1.499 2.855 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 86' ' ' GLU . 0.3 OUTLIER -153.88 5.51 0.3 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.312 -1.111 . . . . 0.0 108.956 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.447 ' N ' HD12 ' A' ' 85' ' ' LEU . 79.3 tt0 -53.43 91.26 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.301 -0.874 . . . . 0.0 110.107 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.44 ' N ' ' O ' ' A' ' 85' ' ' LEU . 46.2 p-80 -79.71 -16.66 55.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.342 -0.849 . . . . 0.0 109.156 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -73.56 111.02 8.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.914 . . . . 0.0 109.049 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 54.0 m170 -83.67 147.44 27.68 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.279 -0.888 . . . . 0.0 109.953 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -71.46 124.06 23.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.329 -0.857 . . . . 0.0 109.58 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 p-80 -79.99 148.88 30.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.263 -0.898 . . . . 0.0 109.762 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.423 179.837 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.508 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -61.91 145.95 96.65 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 122.534 2.156 . . . . 0.0 112.17 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -159.85 -39.91 0.05 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.314 -0.866 . . . . 0.0 109.406 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.7 pttt -160.7 57.88 0.32 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.2 -0.938 . . . . 0.0 109.616 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -53.58 165.28 0.42 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.15 -0.969 . . . . 0.0 109.537 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -96.98 0.02 48.16 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.188 -0.945 . . . . 0.0 110.183 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.52 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -84.18 -43.65 0.75 Allowed Pre-proline 0 N--CA 1.503 2.179 0 O-C-N 120.98 -1.075 . . . . 0.0 110.027 -179.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' A' ' 7' ' ' HIS . 16.2 Cg_exo -66.13 140.73 60.62 Favored 'Trans proline' 0 N--CA 1.5 1.876 0 C-N-CA 122.346 2.03 . . . . 0.0 111.928 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 9' ' ' LEU . 9.9 mp -64.79 -43.59 92.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.148 -0.97 . . . . 0.0 109.346 179.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -63.48 -46.86 84.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.124 -0.985 . . . . 0.0 110.056 -179.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -65.82 -34.87 79.15 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.163 -0.96 . . . . 0.0 109.608 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.7 ttt -60.9 -51.98 66.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.142 -0.974 . . . . 0.0 109.982 -179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -69.7 -39.73 76.73 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.999 -1.063 . . . . 0.0 109.748 179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 95.8 m -60.4 -45.24 94.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.025 -1.047 . . . . 0.0 109.641 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.3 p -61.94 -42.95 99.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.212 -0.93 . . . . 0.0 110.12 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -72.85 -46.05 55.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.061 -1.024 . . . . 0.0 110.843 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.1 mt -62.49 -46.6 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.046 -1.034 . . . . 0.0 109.723 -178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -67.83 -34.19 76.24 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.326 -0.859 . . . . 0.0 109.843 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.84 92.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.334 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -100.46 5.74 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.395 0 O-C-N 121.317 -0.865 . . . . 0.0 109.702 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -67.14 -7.7 25.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.013 -1.054 . . . . 0.0 108.877 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -61.91 81.38 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.218 -0.926 . . . . 0.0 109.933 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 21' ' ' ALA . 34.7 t70 -173.54 -50.81 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.0 t -168.87 -30.69 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.772 . . . . 0.0 109.505 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.38 -64.08 0.33 Allowed Glycine 0 N--CA 1.498 2.809 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.546 ' CH2' ' NE2' ' A' ' 66' ' ' GLN . 94.2 m95 -54.28 -174.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -1.137 . . . . 0.0 110.166 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -155.3 136.64 14.03 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.375 -0.828 . . . . 0.0 108.86 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.414 ' OE1' ' N ' ' A' ' 28' ' ' GLU . 56.5 mp0 -73.78 132.03 42.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.286 -0.884 . . . . 0.0 109.684 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.24 -40.81 74.73 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.329 -0.857 . . . . 0.0 109.172 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.2 m -57.09 -42.92 81.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.036 -1.04 . . . . 0.0 109.111 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.04 -38.32 90.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.251 -0.906 . . . . 0.0 109.514 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 92.9 t -63.13 -48.84 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 109.542 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.15 -44.73 97.32 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.6 p -68.39 -42.01 79.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.196 -1.179 . . . . 0.0 109.892 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CE2' ' ND2' ' A' ' 39' ' ' ASN . 67.7 t80 -61.64 -47.9 83.31 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.152 -0.967 . . . . 0.0 109.57 -179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.08 -40.82 98.8 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.236 -0.915 . . . . 0.0 108.753 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.34 77.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.104 -0.998 . . . . 0.0 109.512 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -61.63 -46.43 89.85 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.992 -1.068 . . . . 0.0 109.371 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.537 ' ND2' ' CE2' ' A' ' 35' ' ' TYR . 69.7 m-80 -65.15 -39.29 92.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.225 -0.922 . . . . 0.0 109.512 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.45 82.99 44.57 Favored Pre-proline 0 N--CA 1.502 2.128 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.27 -29.69 68.45 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 C-N-CA 122.382 2.055 . . . . 0.0 111.1 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.1 m -67.63 -7.91 30.38 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.544 -0.723 . . . . 0.0 109.647 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -88.96 123.07 32.96 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.383 -0.823 . . . . 0.0 108.785 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -124.93 82.26 61.29 Favored Pre-proline 0 N--CA 1.502 2.153 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.505 ' O ' ' N ' ' A' ' 49' ' ' GLY . 34.1 Cg_endo -75.59 -33.64 3.89 Favored 'Trans proline' 0 N--CA 1.488 1.175 0 C-N-CA 121.579 1.519 . . . . 0.0 110.947 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.605 HH11 ' HG3' ' A' ' 46' ' ' ARG . 80.6 mtt85 -62.85 -43.61 98.34 Favored 'General case' 0 N--CA 1.492 1.656 0 N-CA-C 108.534 -0.914 . . . . 0.0 108.534 179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -48.22 -31.53 5.93 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -178.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.8 p-90 -133.42 24.81 4.12 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 179.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 45' ' ' PRO . . . -169.87 55.9 0.2 Allowed Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -60.32 -47.2 87.03 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.359 -1.083 . . . . 0.0 109.48 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.51 -29.57 0.42 Allowed Glycine 0 N--CA 1.504 3.193 0 N-CA-C 109.112 -1.595 . . . . 0.0 109.112 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -5.1 2.66 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.369 -1.077 . . . . 0.0 109.177 -179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.27 -39.47 93.01 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.885 -1.134 . . . . 0.0 108.796 179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.4 t -59.22 -39.9 84.15 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.366 -0.834 . . . . 0.0 109.371 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -75.83 -26.85 57.57 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.089 -1.007 . . . . 0.0 109.886 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.4 mmt -64.73 -43.21 94.11 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.775 -1.203 . . . . 0.0 109.633 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.413 HG22 ' H ' ' A' ' 57' ' ' VAL . 15.9 m -69.99 -22.39 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.236 -0.915 . . . . 0.0 109.62 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -62.69 -30.8 71.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 109.355 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -63.22 -34.25 77.25 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.206 -0.934 . . . . 0.0 109.272 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -73.97 116.05 14.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.356 -0.84 . . . . 0.0 109.334 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.453 ' C ' ' H ' ' A' ' 63' ' ' LEU . 90.0 m-20 -64.57 -40.78 96.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.538 -0.726 . . . . 0.0 111.596 -178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -70.57 19.03 0.05 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.634 -1.291 . . . . 0.0 111.349 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.453 ' H ' ' C ' ' A' ' 61' ' ' ASP . 9.9 mt -136.39 122.25 19.97 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.33 -0.856 . . . . 0.0 109.05 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 97.5 m -91.55 137.65 32.2 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.4 t -116.63 128.23 74.05 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 O-C-N 121.617 -0.677 . . . . 0.0 109.835 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.546 ' NE2' ' CH2' ' A' ' 26' ' ' TRP . 26.7 mt-30 -145.06 146.42 31.85 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 67' ' ' GLU . 55.4 mp0 -95.92 148.49 22.57 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -127.82 140.23 52.16 Favored 'General case' 0 N--CA 1.503 2.197 0 CA-C-O 121.677 0.751 . . . . 0.0 109.498 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.646 HH11 ' HG2' ' A' ' 69' ' ' ARG . 3.3 mmt-85 -77.01 131.54 38.51 Favored 'General case' 0 N--CA 1.497 1.897 0 CA-C-O 121.42 0.629 . . . . 0.0 109.796 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -149.01 101.51 3.17 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.537 -0.727 . . . . 0.0 110.298 -178.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 59.03 -142.62 46.35 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 178.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.8 t -85.68 1.46 49.28 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -1.202 . . . . 0.0 110.15 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -139.04 117.11 11.73 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.359 -0.838 . . . . 0.0 109.564 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -73.97 174.1 9.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.508 -0.745 . . . . 0.0 109.033 179.553 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -144.24 137.67 27.47 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.206 -0.934 . . . . 0.0 109.574 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.2 t -70.22 150.41 46.46 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.488 -0.757 . . . . 0.0 109.402 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -134.94 150.81 50.44 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 pt -132.72 152.61 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.038 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -149.96 152.49 35.04 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.5 mt -80.04 109.26 14.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.161 -0.962 . . . . 0.0 109.043 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -69.18 -14.83 63.21 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.47 -0.769 . . . . 0.0 110.016 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 82.2 t60 54.22 80.79 0.11 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -76.95 -1.54 29.18 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.754 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -50.49 -80.4 0.06 OUTLIER Glycine 0 N--CA 1.495 2.626 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.9 mt 52.61 -120.24 1.65 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.375 -1.073 . . . . 0.0 109.779 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -78.92 -6.95 57.47 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.115 -0.99 . . . . 0.0 109.826 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 49.73 92.39 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.224 -0.922 . . . . 0.0 110.306 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 41.8 t-80 -167.84 87.23 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.4 -0.812 . . . . 0.0 109.443 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -151.4 142.81 23.46 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.1 -1.0 . . . . 0.0 109.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -90.84 118.29 30.13 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.336 -0.853 . . . . 0.0 109.63 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -66.48 -43.88 84.22 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.283 -0.886 . . . . 0.0 109.939 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.3 m80 . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.457 -179.803 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -66.75 152.89 79.67 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 122.057 1.838 . . . . 0.0 112.09 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -152.88 150.84 29.72 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.476 -0.765 . . . . 0.0 109.307 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -88.06 1.12 55.01 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.324 -0.86 . . . . 0.0 109.796 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -55.76 -173.51 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.078 -1.014 . . . . 0.0 109.366 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -71.34 119.52 15.59 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.641 ' CD2' ' H ' ' A' ' 7' ' ' HIS . 0.2 OUTLIER -74.37 178.67 1.57 Allowed Pre-proline 0 N--CA 1.499 2.001 0 O-C-N 121.372 -0.83 . . . . 0.0 109.091 -179.071 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 144.62 98.91 Favored 'Trans proline' 0 N--CA 1.499 1.845 0 C-N-CA 121.854 1.703 . . . . 0.0 111.882 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.6 mt -63.99 -42.13 97.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.256 -0.902 . . . . 0.0 109.432 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -64.79 -45.91 84.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.882 . . . . 0.0 109.594 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -66.11 -27.16 67.84 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.271 -0.893 . . . . 0.0 109.15 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.474 ' SD ' HD22 ' A' ' 36' ' ' LEU . 4.7 tpt -67.5 -63.73 1.0 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.474 -0.766 . . . . 0.0 110.309 -179.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -61.89 -45.81 92.11 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.213 -0.929 . . . . 0.0 110.542 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.3 p -59.81 -44.06 94.19 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.995 -1.066 . . . . 0.0 110.408 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 11.6 t -61.11 -46.07 92.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.914 -1.117 . . . . 0.0 110.145 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.97 -48.39 45.31 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.386 -0.822 . . . . 0.0 110.837 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.417 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 91.5 mt -61.57 -48.07 90.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.132 -0.98 . . . . 0.0 109.711 -178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -66.91 -25.12 66.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.255 -0.903 . . . . 0.0 109.546 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.94 -32.73 51.68 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.024 -1.048 . . . . 0.0 110.564 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.465 ' C ' ' H ' ' A' ' 22' ' ' ARG . 5.9 m -108.32 -0.41 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.959 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' A' ' 23' ' ' ASP . . . -71.82 16.08 0.13 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.915 -1.116 . . . . 0.0 109.081 179.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.465 ' H ' ' C ' ' A' ' 20' ' ' VAL . 9.8 mtp180 -48.77 -13.02 0.05 OUTLIER 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.881 -1.137 . . . . 0.0 110.422 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.456 ' N ' ' O ' ' A' ' 21' ' ' ALA . 25.6 p30 -74.22 -5.89 44.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.241 -0.912 . . . . 0.0 109.339 179.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.7 p 68.8 40.45 1.73 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.475 -0.766 . . . . 0.0 109.194 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -179.74 -140.37 4.12 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -54.63 -170.33 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.902 . . . . 0.0 110.064 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.28 139.76 20.52 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.221 -0.924 . . . . 0.0 108.954 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 47.9 tp10 -69.93 128.04 34.97 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 109.343 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.2 tp -59.5 -39.27 83.27 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.427 -0.795 . . . . 0.0 109.186 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.0 m -55.68 -43.82 76.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.921 -1.112 . . . . 0.0 109.402 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.93 -37.88 89.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.319 -0.863 . . . . 0.0 109.205 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 75.7 t -62.92 -48.55 87.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.219 -0.925 . . . . 0.0 109.74 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.19 -44.93 97.03 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 t -62.98 -45.06 94.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.222 -1.164 . . . . 0.0 109.953 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -61.04 -48.77 80.21 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.985 -1.072 . . . . 0.0 109.438 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 40' ' ' ASP . 93.0 mt -65.01 -41.18 95.56 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.216 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.36 -45.69 80.36 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.871 -1.143 . . . . 0.0 109.631 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -64.65 -42.3 95.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -0.884 . . . . 0.0 110.095 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -86.67 -4.56 59.19 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.08 -1.013 . . . . 0.0 109.689 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.489 ' N ' ' O ' ' A' ' 36' ' ' LEU . 16.4 m-20 -154.48 63.76 4.22 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.428 ' C ' ' H ' ' A' ' 43' ' ' PHE . 13.6 Cg_endo -54.76 -166.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.739 1.626 . . . . 0.0 111.859 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.1 t 69.36 -6.24 1.0 Allowed 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 -178.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 41' ' ' PRO . 1.6 t80 -77.51 135.68 38.25 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.234 -0.916 . . . . 0.0 108.661 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -123.82 84.6 54.1 Favored Pre-proline 0 N--CA 1.503 2.218 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -62.56 -25.35 75.55 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 C-N-CA 121.905 1.737 . . . . 0.0 110.649 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 48' ' ' TRP . 47.7 mmm-85 -66.57 -37.74 85.59 Favored 'General case' 0 C--N 1.289 -2.036 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.951 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -55.55 -7.6 0.28 Allowed 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.444 -0.785 . . . . 0.0 110.052 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.416 ' H ' ' C ' ' A' ' 46' ' ' ARG . 65.3 m95 -97.27 -15.79 20.64 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 121.136 -0.977 . . . . 0.0 109.613 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.408 ' O ' ' O ' ' A' ' 48' ' ' TRP . . . 49.76 101.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.643 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 82.1 t60 51.03 84.4 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.096 -1.237 . . . . 0.0 110.469 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 159.33 -57.36 0.33 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 45.4 mtm180 48.29 -133.19 1.39 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.487 -1.008 . . . . 0.0 110.225 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.497 ' N ' HD12 ' A' ' 53' ' ' LEU . 10.3 mp -63.78 -36.57 84.34 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.1 p -49.57 -31.2 9.97 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.554 -0.716 . . . . 0.0 109.377 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -82.69 -40.66 20.33 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 33.6 tpp -62.4 -46.99 86.09 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.191 -0.943 . . . . 0.0 109.89 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.6 m -64.64 -35.37 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.082 -1.011 . . . . 0.0 109.615 -179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -57.45 -42.64 82.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.433 -0.792 . . . . 0.0 109.451 -179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -67.24 -44.37 79.62 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.025 -1.047 . . . . 0.0 109.262 178.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 65.3 mt -75.56 143.26 42.51 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.444 -0.785 . . . . 0.0 109.94 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 63' ' ' LEU . 71.4 m-20 -92.85 -150.86 0.28 Allowed 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.335 -0.853 . . . . 0.0 109.913 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 61' ' ' ASP . 54.4 p90 42.45 19.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.527 -0.733 . . . . 0.0 111.17 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.473 ' N ' ' O ' ' A' ' 61' ' ' ASP . 15.7 mt -132.52 130.07 39.93 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.567 -0.708 . . . . 0.0 109.543 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 88.7 m -89.38 134.63 33.99 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 53.3 t -120.19 130.55 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.317 0 O-C-N 121.553 -0.717 . . . . 0.0 109.109 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -151.25 118.73 6.04 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -124.25 135.73 53.62 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.661 0.743 . . . . 0.0 109.705 -178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 29.7 t -100.23 125.23 46.38 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 mtt180 -68.73 135.59 51.52 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.026 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -150.0 103.89 3.24 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.483 -0.761 . . . . 0.0 109.737 -179.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 57.74 -142.49 43.56 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 33.3 t -84.74 -9.03 58.6 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.284 -1.127 . . . . 0.0 110.247 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -121.45 116.55 24.95 Favored 'General case' 0 N--CA 1.504 2.272 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -89.7 151.17 21.99 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.955 -1.09 . . . . 0.0 108.519 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -99.77 99.95 10.84 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.364 -0.835 . . . . 0.0 109.066 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.5 t -75.37 146.58 40.74 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.407 -0.808 . . . . 0.0 109.217 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -142.75 143.64 32.31 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 36.9 pt -133.63 155.65 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 CA-C-O 121.48 0.657 . . . . 0.0 109.77 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.5 ttt85 -150.23 150.73 31.97 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.502 HD13 ' N ' ' A' ' 81' ' ' ARG . 0.4 OUTLIER -72.53 121.62 19.97 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.502 ' N ' HD13 ' A' ' 80' ' ' LEU . 7.7 tpt180 -54.67 135.37 46.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.451 -0.78 . . . . 0.0 110.268 -178.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.471 ' O ' ' ND1' ' A' ' 82' ' ' HIS . 9.9 p80 -57.09 92.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.244 -0.91 . . . . 0.0 108.665 179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.43 ' N ' ' O ' ' A' ' 81' ' ' ARG . 97.7 m-20 -83.7 112.53 20.14 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.203 -0.936 . . . . 0.0 109.2 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 178.83 -150.34 9.5 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.407 HD23 ' C ' ' A' ' 85' ' ' LEU . 2.1 tt 58.16 94.92 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.372 -1.075 . . . . 0.0 108.982 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -98.56 55.94 1.1 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.403 -0.811 . . . . 0.0 109.637 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 64.1 t-80 52.12 77.95 0.14 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.419 -0.801 . . . . 0.0 110.451 179.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -74.88 149.53 39.49 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.314 -0.866 . . . . 0.0 109.15 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 p-80 -154.1 148.61 26.22 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.029 -1.045 . . . . 0.0 109.52 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -148.06 142.34 26.21 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.36 -0.838 . . . . 0.0 109.429 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 70.3 m80 48.37 85.7 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.367 -0.833 . . . . 0.0 110.189 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.551 -179.887 . . . . . . . . 0 0 . 1 stop_ save_